NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
|
|
374398 |
1e0a   |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1e0a
save_distance_constraint_statistics_1
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 1
_Distance_constraint_stats_list.Constraint_count 1145
_Distance_constraint_stats_list.Viol_count 1268
_Distance_constraint_stats_list.Viol_total 1269.051
_Distance_constraint_stats_list.Viol_max 0.472
_Distance_constraint_stats_list.Viol_rms 0.0170
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0028
_Distance_constraint_stats_list.Viol_average_violations_only 0.0500
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 2 GLN 0.003 0.003 18 0 "[ . 1 . 2]"
1 3 THR 0.183 0.038 9 0 "[ . 1 . 2]"
1 4 ILE 0.514 0.060 5 0 "[ . 1 . 2]"
1 5 LYS 0.298 0.103 14 0 "[ . 1 . 2]"
1 6 CYS 0.199 0.059 14 0 "[ . 1 . 2]"
1 7 VAL 0.131 0.084 20 0 "[ . 1 . 2]"
1 8 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 VAL 0.053 0.022 10 0 "[ . 1 . 2]"
1 10 GLY 0.105 0.094 1 0 "[ . 1 . 2]"
1 11 ASP 0.528 0.069 18 0 "[ . 1 . 2]"
1 12 GLY 0.161 0.065 14 0 "[ . 1 . 2]"
1 13 ALA 1.548 0.329 16 0 "[ . 1 . 2]"
1 15 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 LYS 1.548 0.329 16 0 "[ . 1 . 2]"
1 17 THR 0.483 0.165 3 0 "[ . 1 . 2]"
1 18 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 19 LEU 0.380 0.057 13 0 "[ . 1 . 2]"
1 20 LEU 1.140 0.180 11 0 "[ . 1 . 2]"
1 21 ILE 3.857 0.374 19 0 "[ . 1 . 2]"
1 22 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 TYR 1.268 0.180 11 0 "[ . 1 . 2]"
1 24 THR 3.673 0.374 19 0 "[ . 1 . 2]"
1 25 THR 1.287 0.153 6 0 "[ . 1 . 2]"
1 26 ASN 0.028 0.028 1 0 "[ . 1 . 2]"
1 27 LYS 0.794 0.159 20 0 "[ . 1 . 2]"
1 28 PHE 2.625 0.243 11 0 "[ . 1 . 2]"
1 29 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 GLU 0.389 0.086 9 0 "[ . 1 . 2]"
1 32 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 33 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 34 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 35 THR 1.824 0.194 9 0 "[ . 1 . 2]"
1 36 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 PHE 0.908 0.060 14 0 "[ . 1 . 2]"
1 38 ASP 3.312 0.194 9 0 "[ . 1 . 2]"
1 39 ASN 0.189 0.082 8 0 "[ . 1 . 2]"
1 40 TYR 2.003 0.178 18 0 "[ . 1 . 2]"
1 41 ALA 0.045 0.018 7 0 "[ . 1 . 2]"
1 42 VAL 0.967 0.056 18 0 "[ . 1 . 2]"
1 43 THR 0.081 0.027 12 0 "[ . 1 . 2]"
1 44 VAL 1.441 0.161 20 0 "[ . 1 . 2]"
1 45 MET 0.059 0.017 14 0 "[ . 1 . 2]"
1 46 ILE 0.323 0.059 12 0 "[ . 1 . 2]"
1 47 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 GLY 0.791 0.073 6 0 "[ . 1 . 2]"
1 49 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 50 PRO 0.187 0.059 12 0 "[ . 1 . 2]"
1 51 TYR 0.234 0.039 15 0 "[ . 1 . 2]"
1 52 THR 0.252 0.038 9 0 "[ . 1 . 2]"
1 53 LEU 0.260 0.056 18 0 "[ . 1 . 2]"
1 54 GLY 0.443 0.060 5 0 "[ . 1 . 2]"
1 55 LEU 0.190 0.098 7 0 "[ . 1 . 2]"
1 56 PHE 0.703 0.119 9 0 "[ . 1 . 2]"
1 57 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 THR 0.047 0.047 15 0 "[ . 1 . 2]"
1 59 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 61 LEU 0.517 0.133 1 0 "[ . 1 . 2]"
1 62 GLU 0.764 0.152 1 0 "[ . 1 . 2]"
1 63 ASP 0.320 0.133 1 0 "[ . 1 . 2]"
1 64 TYR 0.836 0.118 14 0 "[ . 1 . 2]"
1 65 ASP 0.588 0.152 1 0 "[ . 1 . 2]"
1 66 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 LEU 3.047 0.218 15 0 "[ . 1 . 2]"
1 68 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 69 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 LEU 1.701 0.250 17 0 "[ . 1 . 2]"
1 71 SER 0.398 0.220 18 0 "[ . 1 . 2]"
1 72 TYR 0.298 0.103 14 0 "[ . 1 . 2]"
1 73 PRO 0.496 0.063 18 0 "[ . 1 . 2]"
1 74 GLN 0.496 0.063 18 0 "[ . 1 . 2]"
1 75 THR 0.090 0.050 18 0 "[ . 1 . 2]"
1 76 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 77 VAL 0.288 0.059 14 0 "[ . 1 . 2]"
1 78 PHE 0.684 0.084 20 0 "[ . 1 . 2]"
1 79 LEU 0.043 0.043 4 0 "[ . 1 . 2]"
1 80 VAL 0.017 0.011 14 0 "[ . 1 . 2]"
1 81 CYS 0.105 0.094 1 0 "[ . 1 . 2]"
1 82 PHE 0.787 0.190 13 0 "[ . 1 . 2]"
1 83 SER 0.919 0.472 13 0 "[ . 1 . 2]"
1 84 VAL 0.276 0.190 13 0 "[ . 1 . 2]"
1 85 VAL 0.480 0.130 7 0 "[ . 1 . 2]"
1 86 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 PRO 0.117 0.076 11 0 "[ . 1 . 2]"
1 88 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 91 GLU 0.004 0.004 7 0 "[ . 1 . 2]"
1 92 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 VAL 0.516 0.108 19 0 "[ . 1 . 2]"
1 94 LYS 0.479 0.079 11 0 "[ . 1 . 2]"
1 95 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 TRP 0.367 0.069 18 0 "[ . 1 . 2]"
1 98 VAL 0.102 0.059 17 0 "[ . 1 . 2]"
1 99 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 ILE 0.238 0.065 1 0 "[ . 1 . 2]"
1 102 THR 0.698 0.077 11 0 "[ . 1 . 2]"
1 103 HIS 0.051 0.039 13 0 "[ . 1 . 2]"
1 104 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 105 CYS 0.066 0.039 13 0 "[ . 1 . 2]"
1 106 PRO 0.690 0.067 17 0 "[ . 1 . 2]"
1 107 LYS 0.767 0.067 17 0 "[ . 1 . 2]"
1 108 THR 0.686 0.082 18 0 "[ . 1 . 2]"
1 109 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 PHE 0.916 0.077 11 0 "[ . 1 . 2]"
1 111 LEU 1.217 0.151 13 0 "[ . 1 . 2]"
1 112 LEU 1.430 0.248 10 0 "[ . 1 . 2]"
1 113 VAL 0.143 0.056 6 0 "[ . 1 . 2]"
1 114 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 THR 0.671 0.472 13 0 "[ . 1 . 2]"
1 116 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 ILE 4.555 0.287 20 0 "[ . 1 . 2]"
1 118 ASP 0.226 0.042 16 0 "[ . 1 . 2]"
1 119 LEU 0.060 0.027 16 0 "[ . 1 . 2]"
1 120 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 ASP 0.004 0.003 1 0 "[ . 1 . 2]"
1 122 ASP 0.060 0.027 16 0 "[ . 1 . 2]"
1 123 PRO 0.093 0.063 2 0 "[ . 1 . 2]"
1 124 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 ILE 0.096 0.063 2 0 "[ . 1 . 2]"
1 127 GLU 0.662 0.053 17 0 "[ . 1 . 2]"
1 128 LYS 0.186 0.036 13 0 "[ . 1 . 2]"
1 129 LEU 0.251 0.092 19 0 "[ . 1 . 2]"
1 130 ALA 0.662 0.053 17 0 "[ . 1 . 2]"
1 131 LYS 0.020 0.017 18 0 "[ . 1 . 2]"
1 132 ASN 0.854 0.071 4 0 "[ . 1 . 2]"
1 133 LYS 0.341 0.132 13 0 "[ . 1 . 2]"
1 134 GLN 0.300 0.085 13 0 "[ . 1 . 2]"
1 135 LYS 0.010 0.010 5 0 "[ . 1 . 2]"
1 136 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 137 ILE 1.682 0.099 13 0 "[ . 1 . 2]"
1 138 THR 0.158 0.059 10 0 "[ . 1 . 2]"
1 139 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 140 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 141 THR 0.067 0.037 10 0 "[ . 1 . 2]"
1 142 ALA 0.320 0.047 16 0 "[ . 1 . 2]"
1 143 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 144 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 145 LEU 0.916 0.100 11 0 "[ . 1 . 2]"
1 146 ALA 0.406 0.174 11 0 "[ . 1 . 2]"
1 147 ARG 0.059 0.036 12 0 "[ . 1 . 2]"
1 148 ASP 0.550 0.100 11 0 "[ . 1 . 2]"
1 149 LEU 0.767 0.270 11 0 "[ . 1 . 2]"
1 150 LYS 0.241 0.062 3 0 "[ . 1 . 2]"
1 151 ALA 0.512 0.174 11 0 "[ . 1 . 2]"
1 152 VAL 0.965 0.245 15 0 "[ . 1 . 2]"
1 153 LYS 2.648 0.270 11 0 "[ . 1 . 2]"
1 154 TYR 0.066 0.066 6 0 "[ . 1 . 2]"
1 155 VAL 0.113 0.071 20 0 "[ . 1 . 2]"
1 156 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 157 CYS 1.199 0.168 5 0 "[ . 1 . 2]"
1 158 SER 0.045 0.045 15 0 "[ . 1 . 2]"
1 159 ALA 1.504 0.202 15 0 "[ . 1 . 2]"
1 160 LEU 2.241 0.243 11 0 "[ . 1 . 2]"
1 161 THR 0.226 0.042 16 0 "[ . 1 . 2]"
1 162 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 163 LYS 1.064 0.069 3 0 "[ . 1 . 2]"
1 164 GLY 1.064 0.069 3 0 "[ . 1 . 2]"
1 165 LEU 1.667 0.202 15 0 "[ . 1 . 2]"
1 166 LYS 1.319 0.158 9 0 "[ . 1 . 2]"
1 167 ASN 0.519 0.097 19 0 "[ . 1 . 2]"
1 168 VAL 0.460 0.085 7 0 "[ . 1 . 2]"
1 169 PHE 0.241 0.057 13 0 "[ . 1 . 2]"
1 170 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 171 GLU 1.657 0.151 13 0 "[ . 1 . 2]"
1 172 ALA 0.043 0.043 4 0 "[ . 1 . 2]"
1 173 ILE 0.400 0.053 9 0 "[ . 1 . 2]"
1 174 LEU 0.606 0.109 7 0 "[ . 1 . 2]"
1 175 ALA 0.077 0.023 11 0 "[ . 1 . 2]"
1 176 ALA 0.022 0.016 8 0 "[ . 1 . 2]"
1 177 LEU 0.021 0.021 18 0 "[ . 1 . 2]"
1 178 GLU 0.064 0.022 20 0 "[ . 1 . 2]"
1 179 PRO 0.036 0.022 20 0 "[ . 1 . 2]"
1 180 PRO 0.024 0.006 17 0 "[ . 1 . 2]"
1 181 GLU 0.303 0.161 20 0 "[ . 1 . 2]"
1 182 PRO 0.056 0.013 20 0 "[ . 1 . 2]"
1 183 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 184 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
2 1 GLY 0.016 0.010 4 0 "[ . 1 . 2]"
2 2 SER 0.827 0.068 15 0 "[ . 1 . 2]"
2 3 ILE 2.682 0.175 15 0 "[ . 1 . 2]"
2 4 SER 0.000 0.000 9 0 "[ . 1 . 2]"
2 5 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 6 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
2 7 SER 1.380 0.161 20 0 "[ . 1 . 2]"
2 8 ASP 0.055 0.027 12 0 "[ . 1 . 2]"
2 9 PHE 1.425 0.153 6 0 "[ . 1 . 2]"
2 10 GLU 0.285 0.121 14 0 "[ . 1 . 2]"
2 11 HIS 0.778 0.093 12 0 "[ . 1 . 2]"
2 12 THR 0.784 0.178 18 0 "[ . 1 . 2]"
2 13 ILE 2.674 0.156 7 0 "[ . 1 . 2]"
2 14 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
2 15 VAL 0.518 0.104 18 0 "[ . 1 . 2]"
2 16 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 17 PHE 0.406 0.039 14 0 "[ . 1 . 2]"
2 18 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
2 19 ALA 0.208 0.029 3 0 "[ . 1 . 2]"
2 20 VAL 0.092 0.092 11 0 "[ . 1 . 2]"
2 21 THR 0.000 0.000 . 0 "[ . 1 . 2]"
2 22 GLY 0.028 0.017 15 0 "[ . 1 . 2]"
2 23 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 24 PHE 0.948 0.114 15 0 "[ . 1 . 2]"
2 25 THR 0.170 0.039 14 0 "[ . 1 . 2]"
2 26 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
2 27 MET 0.429 0.089 17 0 "[ . 1 . 2]"
2 28 PRO 2.214 0.218 15 0 "[ . 1 . 2]"
2 29 GLU 0.315 0.128 6 0 "[ . 1 . 2]"
2 30 GLN 0.606 0.218 12 0 "[ . 1 . 2]"
2 31 TRP 0.814 0.118 14 0 "[ . 1 . 2]"
2 32 ALA 0.661 0.128 6 0 "[ . 1 . 2]"
2 33 ARG 2.980 0.218 12 0 "[ . 1 . 2]"
2 34 LEU 0.475 0.094 19 0 "[ . 1 . 2]"
2 35 LEU 0.117 0.097 15 0 "[ . 1 . 2]"
2 36 GLN 2.119 0.177 8 0 "[ . 1 . 2]"
2 37 THR 0.464 0.071 2 0 "[ . 1 . 2]"
2 38 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 39 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
2 40 ILE 0.856 0.097 7 0 "[ . 1 . 2]"
2 41 THR 0.625 0.065 5 0 "[ . 1 . 2]"
2 42 LYS 0.523 0.060 16 0 "[ . 1 . 2]"
2 43 SER 0.000 0.000 . 0 "[ . 1 . 2]"
2 44 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
2 45 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 46 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 177 LEU QD 2 2 SER QB 6.000 . 6.000 5.906 5.514 6.021 0.021 18 0 "[ . 1 . 2]" 1
2 2 3 ILE H 2 3 ILE HB . . 3.500 3.020 2.504 3.336 . 0 0 "[ . 1 . 2]" 1
3 1 46 ILE HA 2 3 ILE MD 5.000 . 5.000 3.741 2.152 4.492 . 0 0 "[ . 1 . 2]" 1
4 1 46 ILE MD 2 3 ILE MD 5.000 . 5.000 2.749 1.815 3.916 . 0 0 "[ . 1 . 2]" 1
5 1 46 ILE MG 2 3 ILE MD 3.500 . 3.500 2.961 1.763 3.507 0.007 18 0 "[ . 1 . 2]" 1
6 1 170 ASP QB 2 3 ILE MD 5.000 . 5.000 3.474 2.183 4.127 . 0 0 "[ . 1 . 2]" 1
7 1 170 ASP H 2 3 ILE MD 5.000 . 5.000 4.013 3.350 4.584 . 0 0 "[ . 1 . 2]" 1
8 1 173 ILE HA 2 3 ILE MD 5.000 . 5.000 4.717 4.294 5.053 0.053 9 0 "[ . 1 . 2]" 1
9 1 174 LEU H 2 3 ILE MD 5.000 . 5.000 3.565 2.787 4.375 . 0 0 "[ . 1 . 2]" 1
10 2 3 ILE HA 2 3 ILE MD 3.500 . 3.500 3.182 2.018 3.675 0.175 15 0 "[ . 1 . 2]" 1
11 2 3 ILE MD 2 3 ILE MG 3.500 . 3.500 2.268 1.857 2.743 . 0 0 "[ . 1 . 2]" 1
12 2 3 ILE H 2 3 ILE MD 5.000 . 5.000 4.488 3.759 4.850 . 0 0 "[ . 1 . 2]" 1
13 2 3 ILE H 2 3 ILE QG 5.000 . 5.000 3.691 2.392 4.126 . 0 0 "[ . 1 . 2]" 1
14 1 46 ILE MD 2 3 ILE MG 5.000 . 5.000 4.478 2.971 5.017 0.017 18 0 "[ . 1 . 2]" 1
15 1 173 ILE MG 2 3 ILE MG 5.000 . 5.000 4.547 3.258 5.051 0.051 4 0 "[ . 1 . 2]" 1
16 2 3 ILE HA 2 3 ILE MG 3.500 . 3.500 2.939 2.333 3.202 . 0 0 "[ . 1 . 2]" 1
17 2 3 ILE MG 2 4 SER H 5.000 . 5.000 3.197 2.114 3.852 . 0 0 "[ . 1 . 2]" 1
18 2 5 LEU HA 2 5 LEU QD 3.500 . 3.500 2.844 2.570 2.990 . 0 0 "[ . 1 . 2]" 1
19 2 5 LEU H 2 5 LEU QD 5.000 . 5.000 3.510 2.908 3.794 . 0 0 "[ . 1 . 2]" 1
20 2 5 LEU QD 2 6 PRO QD 5.000 . 5.000 2.137 1.851 3.060 . 0 0 "[ . 1 . 2]" 1
21 2 5 LEU H 2 5 LEU HG 5.000 . 5.000 4.061 3.616 4.374 . 0 0 "[ . 1 . 2]" 1
22 1 42 VAL HA 2 6 PRO QB 5.000 . 5.000 2.252 2.001 2.596 . 0 0 "[ . 1 . 2]" 1
23 1 42 VAL HB 2 6 PRO QB 5.000 . 5.000 2.028 1.864 2.619 . 0 0 "[ . 1 . 2]" 1
24 1 42 VAL QG 2 6 PRO QB 5.000 . 5.000 2.034 1.766 2.639 . 0 0 "[ . 1 . 2]" 1
25 1 42 VAL QG 2 6 PRO QD 5.000 . 5.000 3.655 3.407 4.037 . 0 0 "[ . 1 . 2]" 1
26 2 7 SER QB 2 8 ASP H 5.000 . 5.000 2.561 1.915 3.399 . 0 0 "[ . 1 . 2]" 1
27 2 8 ASP HA 2 9 PHE H 5.000 . 5.000 2.372 2.138 3.525 . 0 0 "[ . 1 . 2]" 1
28 2 9 PHE H 2 9 PHE QB . . 3.500 2.580 2.224 3.045 . 0 0 "[ . 1 . 2]" 1
29 1 24 THR HB 2 9 PHE QD 5.000 . 5.000 3.517 2.671 4.717 . 0 0 "[ . 1 . 2]" 1
30 1 42 VAL QG 2 9 PHE QD . . 3.500 3.106 1.810 3.553 0.053 20 0 "[ . 1 . 2]" 1
31 1 24 THR HB 2 9 PHE QE 5.000 . 5.000 4.294 2.179 5.008 0.008 2 0 "[ . 1 . 2]" 1
32 1 24 THR MG 2 9 PHE QE 5.000 . 5.000 4.348 2.396 5.018 0.018 4 0 "[ . 1 . 2]" 1
33 1 42 VAL QG 2 9 PHE QE 5.000 . 5.000 4.482 2.141 5.025 0.025 18 0 "[ . 1 . 2]" 1
34 1 21 ILE MD 2 9 PHE HZ 5.000 . 5.000 2.566 1.783 4.077 . 0 0 "[ . 1 . 2]" 1
35 2 10 GLU HA 2 11 HIS H . . 3.500 2.182 2.146 2.240 . 0 0 "[ . 1 . 2]" 1
36 1 41 ALA H 2 10 GLU QB 5.000 . 5.000 4.365 2.942 5.018 0.018 7 0 "[ . 1 . 2]" 1
37 1 41 ALA H 2 10 GLU QG 5.000 . 5.000 3.447 2.515 5.010 0.010 20 0 "[ . 1 . 2]" 1
38 2 10 GLU H 2 10 GLU QG 5.000 . 5.000 2.723 2.357 4.229 . 0 0 "[ . 1 . 2]" 1
39 2 10 GLU QG 2 12 THR MG . . 3.500 2.765 1.910 3.621 0.121 14 0 "[ . 1 . 2]" 1
40 2 11 HIS HA 2 11 HIS HD2 5.000 . 5.000 2.482 2.010 4.451 . 0 0 "[ . 1 . 2]" 1
41 2 11 HIS HD2 2 12 THR H 5.000 . 5.000 3.642 2.998 4.825 . 0 0 "[ . 1 . 2]" 1
42 2 11 HIS HD2 2 13 ILE H 5.000 . 5.000 4.235 3.172 5.005 0.005 20 0 "[ . 1 . 2]" 1
43 2 12 THR HA 2 12 THR MG . . 2.800 2.236 2.008 2.687 . 0 0 "[ . 1 . 2]" 1
44 2 12 THR HA 2 13 ILE H 5.000 . 5.000 3.567 3.534 3.599 . 0 0 "[ . 1 . 2]" 1
45 2 12 THR HB 2 13 ILE H 5.000 . 5.000 2.547 1.939 4.024 . 0 0 "[ . 1 . 2]" 1
46 1 40 TYR HA 2 12 THR MG 5.000 . 5.000 3.741 2.847 4.592 . 0 0 "[ . 1 . 2]" 1
47 1 41 ALA H 2 12 THR MG 5.000 . 5.000 4.514 4.029 5.013 0.013 14 0 "[ . 1 . 2]" 1
48 2 12 THR H 2 12 THR MG 3.500 . 3.500 2.732 1.945 3.344 . 0 0 "[ . 1 . 2]" 1
49 2 12 THR MG 2 13 ILE H 5.000 . 5.000 3.591 3.232 3.856 . 0 0 "[ . 1 . 2]" 1
50 2 13 ILE HA 2 13 ILE MG . . 3.500 2.138 2.047 2.286 . 0 0 "[ . 1 . 2]" 1
51 2 13 ILE HA 2 14 HIS H . . 3.500 2.174 2.136 2.296 . 0 0 "[ . 1 . 2]" 1
52 1 37 PHE QD 2 13 ILE MD 3.500 . 3.500 3.472 3.339 3.537 0.037 8 0 "[ . 1 . 2]" 1
53 1 38 ASP HA 2 13 ILE MD 5.000 . 5.000 4.903 4.182 5.051 0.051 8 0 "[ . 1 . 2]" 1
54 1 39 ASN QB 2 13 ILE MD 5.000 . 5.000 1.831 1.760 1.977 . 0 0 "[ . 1 . 2]" 1
55 1 40 TYR H 2 13 ILE MD 5.000 . 5.000 5.001 4.850 5.156 0.156 7 0 "[ . 1 . 2]" 1
56 1 56 PHE QE 2 13 ILE MD 5.000 . 5.000 5.013 4.713 5.119 0.119 9 0 "[ . 1 . 2]" 1
57 2 13 ILE H 2 13 ILE MD 5.000 . 5.000 2.376 1.882 3.221 . 0 0 "[ . 1 . 2]" 1
58 1 37 PHE QD 2 13 ILE MG 3.500 . 3.500 3.310 2.821 3.545 0.045 5 0 "[ . 1 . 2]" 1
59 1 38 ASP HA 2 13 ILE MG 5.000 . 5.000 4.942 4.263 5.121 0.121 20 0 "[ . 1 . 2]" 1
60 1 39 ASN QB 2 13 ILE MG 5.000 . 5.000 4.379 3.931 4.726 . 0 0 "[ . 1 . 2]" 1
61 1 39 ASN H 2 13 ILE MG 5.000 . 5.000 4.860 4.625 5.082 0.082 8 0 "[ . 1 . 2]" 1
62 2 13 ILE MG 2 14 HIS H 5.000 . 5.000 2.601 1.998 3.157 . 0 0 "[ . 1 . 2]" 1
63 1 38 ASP HA 2 14 HIS HA 5.000 . 5.000 2.717 2.173 3.125 . 0 0 "[ . 1 . 2]" 1
64 2 14 HIS HA 2 15 VAL H 5.000 . 5.000 2.204 2.192 2.211 . 0 0 "[ . 1 . 2]" 1
65 1 36 VAL QG 2 15 VAL QG 3.500 . 3.500 1.934 1.646 2.194 . 0 0 "[ . 1 . 2]" 1
66 1 37 PHE QD 2 15 VAL QG 5.000 . 5.000 2.177 1.964 2.544 . 0 0 "[ . 1 . 2]" 1
67 1 67 LEU QD 2 15 VAL QG . . 3.500 3.486 3.159 3.604 0.104 18 0 "[ . 1 . 2]" 1
68 2 15 VAL QG 2 16 GLY H 5.000 . 5.000 2.186 1.891 2.753 . 0 0 "[ . 1 . 2]" 1
69 2 15 VAL QG 2 24 PHE QD 5.000 . 5.000 2.811 1.876 3.367 . 0 0 "[ . 1 . 2]" 1
70 2 15 VAL QG 2 27 MET HA 5.000 . 5.000 2.478 1.764 3.350 . 0 0 "[ . 1 . 2]" 1
71 2 15 VAL QG 2 27 MET QG 5.000 . 5.000 3.321 2.507 4.661 . 0 0 "[ . 1 . 2]" 1
72 1 36 VAL QG 2 17 PHE QB 5.000 . 5.000 3.414 2.708 4.093 . 0 0 "[ . 1 . 2]" 1
73 1 36 VAL QG 2 17 PHE QD 5.000 . 5.000 3.778 3.224 4.384 . 0 0 "[ . 1 . 2]" 1
74 2 17 PHE H 2 17 PHE QD 5.000 . 5.000 4.247 4.181 4.308 . 0 0 "[ . 1 . 2]" 1
75 2 17 PHE QD 2 18 ASP H 5.000 . 5.000 3.161 1.990 3.844 . 0 0 "[ . 1 . 2]" 1
76 2 17 PHE QD 2 19 ALA HA 5.000 . 5.000 4.577 3.707 5.010 0.010 20 0 "[ . 1 . 2]" 1
77 2 17 PHE QD 2 24 PHE HA 5.000 . 5.000 4.294 3.481 4.937 . 0 0 "[ . 1 . 2]" 1
78 2 17 PHE QE 2 19 ALA HA 5.000 . 5.000 3.544 2.745 4.282 . 0 0 "[ . 1 . 2]" 1
79 2 17 PHE QE 2 19 ALA MB . . 3.500 3.292 2.653 3.529 0.029 15 0 "[ . 1 . 2]" 1
80 2 17 PHE QE 2 22 GLY QA 5.000 . 5.000 4.018 3.396 4.790 . 0 0 "[ . 1 . 2]" 1
81 2 17 PHE HZ 2 19 ALA HA 5.000 . 5.000 4.677 3.624 5.029 0.029 3 0 "[ . 1 . 2]" 1
82 2 17 PHE HZ 2 22 GLY QA 5.000 . 5.000 4.207 3.640 5.017 0.017 15 0 "[ . 1 . 2]" 1
83 2 18 ASP QB 2 19 ALA H . . 5.000 3.703 3.151 3.946 . 0 0 "[ . 1 . 2]" 1
84 2 19 ALA HA 2 20 VAL H 5.000 . 5.000 3.336 3.271 3.437 . 0 0 "[ . 1 . 2]" 1
85 2 19 ALA HA 2 21 THR H 6.000 . 6.000 3.567 3.290 4.342 . 0 0 "[ . 1 . 2]" 1
86 2 19 ALA HA 2 22 GLY QA 5.000 . 5.000 3.090 2.654 3.682 . 0 0 "[ . 1 . 2]" 1
87 2 19 ALA HA 2 22 GLY H 5.000 . 5.000 3.138 2.438 3.709 . 0 0 "[ . 1 . 2]" 1
88 2 19 ALA HA 2 23 GLU H 5.000 . 5.000 4.246 3.690 4.994 . 0 0 "[ . 1 . 2]" 1
89 2 17 PHE QD 2 19 ALA MB 5.000 . 5.000 4.083 3.010 4.740 . 0 0 "[ . 1 . 2]" 1
90 2 19 ALA H 2 19 ALA MB 3.500 . 3.500 2.154 2.056 2.253 . 0 0 "[ . 1 . 2]" 1
91 2 19 ALA MB 2 20 VAL H 3.500 . 3.500 3.231 2.935 3.373 . 0 0 "[ . 1 . 2]" 1
92 2 20 VAL HA 2 20 VAL QG . . 2.800 2.254 2.100 2.344 . 0 0 "[ . 1 . 2]" 1
93 2 20 VAL HA 2 21 THR H 5.000 . 5.000 3.502 3.461 3.577 . 0 0 "[ . 1 . 2]" 1
94 2 20 VAL H 2 20 VAL HB 3.500 . 3.500 2.561 2.430 3.592 0.092 11 0 "[ . 1 . 2]" 1
95 2 20 VAL HB 2 21 THR H 5.000 . 5.000 3.750 2.254 4.091 . 0 0 "[ . 1 . 2]" 1
96 2 19 ALA H 2 20 VAL QG 5.000 . 5.000 4.022 3.549 4.273 . 0 0 "[ . 1 . 2]" 1
97 2 20 VAL H 2 20 VAL QG 3.500 . 3.500 2.180 1.891 2.380 . 0 0 "[ . 1 . 2]" 1
98 2 20 VAL QG 2 21 THR H . . 3.500 2.222 1.848 3.167 . 0 0 "[ . 1 . 2]" 1
99 2 20 VAL H 2 21 THR MG 5.000 . 5.000 4.334 4.022 4.989 . 0 0 "[ . 1 . 2]" 1
100 2 21 THR H 2 21 THR MG 3.500 . 3.500 2.350 1.941 2.964 . 0 0 "[ . 1 . 2]" 1
101 2 21 THR MG 2 22 GLY H 5.000 . 5.000 2.958 1.866 4.364 . 0 0 "[ . 1 . 2]" 1
102 2 22 GLY QA 2 23 GLU H 5.000 . 5.000 2.835 2.750 2.934 . 0 0 "[ . 1 . 2]" 1
103 2 23 GLU QB 2 24 PHE H 5.000 . 5.000 2.068 1.930 2.462 . 0 0 "[ . 1 . 2]" 1
104 2 23 GLU H 2 23 GLU QG 5.000 . 5.000 2.292 2.002 2.579 . 0 0 "[ . 1 . 2]" 1
105 2 23 GLU QG 2 24 PHE H 5.000 . 5.000 2.730 2.227 3.967 . 0 0 "[ . 1 . 2]" 1
106 2 23 GLU QG 2 25 THR MG 5.000 . 5.000 4.249 3.682 4.735 . 0 0 "[ . 1 . 2]" 1
107 2 17 PHE HA 2 24 PHE HA 5.000 . 5.000 2.611 2.366 2.879 . 0 0 "[ . 1 . 2]" 1
108 2 18 ASP H 2 24 PHE HA 5.000 . 5.000 2.685 1.956 3.319 . 0 0 "[ . 1 . 2]" 1
109 2 24 PHE HA 2 25 THR H 5.000 . 5.000 2.392 2.256 2.416 . 0 0 "[ . 1 . 2]" 1
110 1 67 LEU QD 2 24 PHE QD 5.000 . 5.000 2.356 2.007 2.725 . 0 0 "[ . 1 . 2]" 1
111 1 70 LEU QD 2 24 PHE QD 5.000 . 5.000 4.920 4.245 5.114 0.114 15 0 "[ . 1 . 2]" 1
112 2 24 PHE H 2 24 PHE QD 5.000 . 5.000 2.918 2.433 3.186 . 0 0 "[ . 1 . 2]" 1
113 2 24 PHE QD 2 27 MET ME . . 3.500 1.938 1.778 2.092 . 0 0 "[ . 1 . 2]" 1
114 1 67 LEU QD 2 24 PHE QE 5.000 . 5.000 1.854 1.733 2.276 . 0 0 "[ . 1 . 2]" 1
115 1 70 LEU QD 2 24 PHE QE 5.000 . 5.000 4.446 3.246 5.033 0.033 15 0 "[ . 1 . 2]" 1
116 2 24 PHE QE 2 27 MET ME . . 3.500 3.411 2.979 3.534 0.034 3 0 "[ . 1 . 2]" 1
117 1 67 LEU QD 2 24 PHE HZ 5.000 . 5.000 2.951 2.186 3.684 . 0 0 "[ . 1 . 2]" 1
118 2 25 THR HB 2 26 GLY H 5.000 . 5.000 2.506 2.080 3.211 . 0 0 "[ . 1 . 2]" 1
119 2 16 GLY H 2 25 THR MG 5.000 . 5.000 4.314 4.021 4.752 . 0 0 "[ . 1 . 2]" 1
120 2 18 ASP H 2 25 THR MG 5.000 . 5.000 3.504 2.630 4.097 . 0 0 "[ . 1 . 2]" 1
121 2 25 THR HA 2 25 THR MG 3.500 . 3.500 2.232 2.086 2.365 . 0 0 "[ . 1 . 2]" 1
122 2 25 THR H 2 25 THR MG 3.500 . 3.500 3.008 2.615 3.266 . 0 0 "[ . 1 . 2]" 1
123 2 26 GLY QA 2 27 MET H 5.000 . 5.000 2.748 2.583 2.845 . 0 0 "[ . 1 . 2]" 1
124 2 27 MET HA 2 28 PRO QD 5.000 . 5.000 1.984 1.901 2.097 . 0 0 "[ . 1 . 2]" 1
125 2 27 MET QB 2 27 MET ME . . 3.500 2.112 1.807 3.246 . 0 0 "[ . 1 . 2]" 1
126 2 27 MET H 2 27 MET QB . . 3.500 2.536 2.062 2.892 . 0 0 "[ . 1 . 2]" 1
127 2 27 MET QB 2 28 PRO QD 5.000 . 5.000 2.903 1.874 3.779 . 0 0 "[ . 1 . 2]" 1
128 2 27 MET QB 2 32 ALA MB 5.000 . 5.000 2.212 1.744 3.725 . 0 0 "[ . 1 . 2]" 1
129 1 67 LEU QD 2 27 MET ME 2.800 . 2.800 1.780 1.600 1.975 . 0 0 "[ . 1 . 2]" 1
130 2 27 MET HA 2 27 MET ME 5.000 . 5.000 2.592 1.905 3.962 . 0 0 "[ . 1 . 2]" 1
131 2 27 MET ME 2 27 MET QG 3.500 . 3.500 2.479 2.082 2.676 . 0 0 "[ . 1 . 2]" 1
132 2 27 MET ME 2 28 PRO QD 5.000 . 5.000 2.462 1.879 3.544 . 0 0 "[ . 1 . 2]" 1
133 2 27 MET H 2 27 MET QG 5.000 . 5.000 2.400 1.871 4.008 . 0 0 "[ . 1 . 2]" 1
134 2 27 MET QG 2 32 ALA MB . . 3.500 2.952 1.776 3.491 . 0 0 "[ . 1 . 2]" 1
135 2 27 MET QG 2 35 LEU QD 5.000 . 5.000 4.239 2.857 5.006 0.006 15 0 "[ . 1 . 2]" 1
136 2 28 PRO HA 2 29 GLU H 3.500 . 3.500 2.243 2.168 2.357 . 0 0 "[ . 1 . 2]" 1
137 2 28 PRO QB 2 30 GLN H . . 5.000 3.172 2.560 3.594 . 0 0 "[ . 1 . 2]" 1
138 2 28 PRO QB 2 31 TRP H 5.000 . 5.000 2.194 1.927 2.560 . 0 0 "[ . 1 . 2]" 1
139 2 13 ILE MD 2 28 PRO QG 5.000 . 5.000 2.732 1.926 3.517 . 0 0 "[ . 1 . 2]" 1
140 2 29 GLU HA 2 32 ALA MB 3.500 . 3.500 3.147 2.550 3.508 0.008 4 0 "[ . 1 . 2]" 1
141 2 29 GLU HA 2 32 ALA H 5.000 . 5.000 4.237 3.630 4.404 . 0 0 "[ . 1 . 2]" 1
142 2 29 GLU H 2 29 GLU QB 3.500 . 3.500 2.320 2.061 2.737 . 0 0 "[ . 1 . 2]" 1
143 2 29 GLU HA 2 29 GLU QG 3.500 . 3.500 2.551 2.017 3.337 . 0 0 "[ . 1 . 2]" 1
144 2 29 GLU H 2 29 GLU QG 5.000 . 5.000 2.610 1.913 3.284 . 0 0 "[ . 1 . 2]" 1
145 2 29 GLU QG 2 32 ALA MB 5.000 . 5.000 4.758 4.080 5.128 0.128 6 0 "[ . 1 . 2]" 1
146 2 29 GLU QG 2 33 ARG QD 5.000 . 5.000 3.942 2.693 4.956 . 0 0 "[ . 1 . 2]" 1
147 2 29 GLU QG 2 33 ARG QG 5.000 . 5.000 4.723 3.898 5.031 0.031 12 0 "[ . 1 . 2]" 1
148 2 30 GLN HA 2 30 GLN QG . . 3.500 2.405 2.070 3.270 . 0 0 "[ . 1 . 2]" 1
149 2 30 GLN HA 2 31 TRP H 5.000 . 5.000 3.566 3.547 3.586 . 0 0 "[ . 1 . 2]" 1
150 2 30 GLN HA 2 33 ARG QB . . 3.500 3.020 2.373 3.718 0.218 12 0 "[ . 1 . 2]" 1
151 2 30 GLN HA 2 33 ARG QD 5.000 . 5.000 2.808 1.935 3.443 . 0 0 "[ . 1 . 2]" 1
152 2 30 GLN HA 2 33 ARG QG 5.000 . 5.000 3.777 1.865 4.577 . 0 0 "[ . 1 . 2]" 1
153 2 30 GLN HA 2 33 ARG H 5.000 . 5.000 3.935 3.496 4.237 . 0 0 "[ . 1 . 2]" 1
154 2 30 GLN H 2 30 GLN QB 3.500 . 3.500 2.275 2.087 2.924 . 0 0 "[ . 1 . 2]" 1
155 2 30 GLN QB 2 31 TRP HD1 5.000 . 5.000 3.127 2.463 4.233 . 0 0 "[ . 1 . 2]" 1
156 2 30 GLN QB 2 31 TRP H 5.000 . 5.000 2.309 2.017 2.983 . 0 0 "[ . 1 . 2]" 1
157 2 30 GLN QB 2 32 ALA H 5.000 . 5.000 4.835 4.571 5.031 0.031 6 0 "[ . 1 . 2]" 1
158 2 30 GLN QB 2 33 ARG QD 5.000 . 5.000 4.387 3.555 5.005 0.005 15 0 "[ . 1 . 2]" 1
159 2 30 GLN H 2 30 GLN QG 5.000 . 5.000 3.753 1.899 4.025 . 0 0 "[ . 1 . 2]" 1
160 2 30 GLN QG 2 33 ARG QD 5.000 . 5.000 4.321 3.015 5.007 0.007 6 0 "[ . 1 . 2]" 1
161 1 70 LEU QD 2 31 TRP HD1 5.000 . 5.000 2.793 1.861 4.420 . 0 0 "[ . 1 . 2]" 1
162 2 30 GLN QG 2 31 TRP HD1 5.000 . 5.000 4.153 2.707 4.995 . 0 0 "[ . 1 . 2]" 1
163 2 31 TRP HA 2 31 TRP HD1 5.000 . 5.000 2.477 1.923 2.911 . 0 0 "[ . 1 . 2]" 1
164 2 31 TRP H 2 31 TRP HD1 5.000 . 5.000 2.730 2.002 3.850 . 0 0 "[ . 1 . 2]" 1
165 1 67 LEU QD 2 31 TRP HE3 5.000 . 5.000 2.214 1.894 2.849 . 0 0 "[ . 1 . 2]" 1
166 1 64 TYR QD 2 31 TRP HH2 5.000 . 5.000 4.129 3.358 4.719 . 0 0 "[ . 1 . 2]" 1
167 1 64 TYR QD 2 31 TRP HZ2 5.000 . 5.000 5.013 4.441 5.118 0.118 14 0 "[ . 1 . 2]" 1
168 1 67 LEU QD 2 31 TRP HZ3 5.000 . 5.000 2.520 1.790 3.665 . 0 0 "[ . 1 . 2]" 1
169 2 32 ALA HA 2 33 ARG H 5.000 . 5.000 3.562 3.542 3.579 . 0 0 "[ . 1 . 2]" 1
170 2 32 ALA HA 2 35 LEU QB 5.000 . 5.000 4.494 3.913 4.910 . 0 0 "[ . 1 . 2]" 1
171 2 32 ALA HA 2 35 LEU QD 5.000 . 5.000 2.902 2.113 3.448 . 0 0 "[ . 1 . 2]" 1
172 2 31 TRP QB 2 32 ALA MB 5.000 . 5.000 3.701 3.625 3.768 . 0 0 "[ . 1 . 2]" 1
173 2 32 ALA H 2 32 ALA MB 3.500 . 3.500 2.094 2.037 2.177 . 0 0 "[ . 1 . 2]" 1
174 2 32 ALA MB 2 33 ARG H 3.500 . 3.500 2.166 1.914 2.444 . 0 0 "[ . 1 . 2]" 1
175 2 32 ALA MB 2 35 LEU QD 5.000 . 5.000 4.113 3.493 4.524 . 0 0 "[ . 1 . 2]" 1
176 2 32 ALA MB 2 33 ARG HA 5.000 . 5.000 3.582 3.528 3.650 . 0 0 "[ . 1 . 2]" 1
177 2 33 ARG HA 2 33 ARG QD 5.000 . 5.000 4.142 3.923 4.534 . 0 0 "[ . 1 . 2]" 1
178 2 33 ARG HA 2 33 ARG QG 3.500 . 3.500 2.605 2.237 3.333 . 0 0 "[ . 1 . 2]" 1
179 2 33 ARG HA 2 34 LEU H 5.000 . 5.000 3.524 3.464 3.549 . 0 0 "[ . 1 . 2]" 1
180 2 33 ARG HA 2 36 GLN QB 5.000 . 5.000 4.877 4.622 5.138 0.138 1 0 "[ . 1 . 2]" 1
181 2 33 ARG HA 2 36 GLN QG 5.000 . 5.000 4.876 4.212 5.177 0.177 8 0 "[ . 1 . 2]" 1
182 2 33 ARG HA 2 36 GLN H 5.000 . 5.000 4.751 4.609 5.036 0.036 19 0 "[ . 1 . 2]" 1
183 2 33 ARG QB 2 33 ARG QD 3.500 . 3.500 2.099 1.989 2.319 . 0 0 "[ . 1 . 2]" 1
184 2 33 ARG H 2 33 ARG QB 3.500 . 3.500 2.473 2.215 2.630 . 0 0 "[ . 1 . 2]" 1
185 2 33 ARG QB 2 34 LEU H 5.000 . 5.000 2.755 2.454 3.572 . 0 0 "[ . 1 . 2]" 1
186 2 32 ALA MB 2 33 ARG QD 5.000 . 5.000 4.482 3.968 5.061 0.061 11 0 "[ . 1 . 2]" 1
187 2 33 ARG H 2 33 ARG QD 5.000 . 5.000 3.526 3.116 4.060 . 0 0 "[ . 1 . 2]" 1
188 2 33 ARG QD 2 34 LEU QD 5.000 . 5.000 4.738 3.749 5.033 0.033 3 0 "[ . 1 . 2]" 1
189 2 33 ARG H 2 33 ARG QG 5.000 . 5.000 2.165 1.919 2.690 . 0 0 "[ . 1 . 2]" 1
190 2 33 ARG QG 2 34 LEU H 5.000 . 5.000 3.839 2.039 4.353 . 0 0 "[ . 1 . 2]" 1
191 2 34 LEU HA 2 34 LEU QD . . 2.800 1.910 1.844 2.021 . 0 0 "[ . 1 . 2]" 1
192 2 31 TRP HA 2 34 LEU QB 5.000 . 5.000 2.546 2.004 2.877 . 0 0 "[ . 1 . 2]" 1
193 2 34 LEU QB 2 34 LEU QD . . 2.800 2.007 1.953 2.092 . 0 0 "[ . 1 . 2]" 1
194 2 34 LEU H 2 34 LEU QB . . 3.500 2.072 2.036 2.297 . 0 0 "[ . 1 . 2]" 1
195 2 34 LEU QB 2 35 LEU H 5.000 . 5.000 2.264 2.049 2.406 . 0 0 "[ . 1 . 2]" 1
196 1 67 LEU HA 2 34 LEU QD 5.000 . 5.000 4.729 3.923 5.094 0.094 19 0 "[ . 1 . 2]" 1
197 1 70 LEU HA 2 34 LEU QD 5.000 . 5.000 3.742 2.376 4.998 . 0 0 "[ . 1 . 2]" 1
198 1 70 LEU QD 2 34 LEU QD . . 3.500 2.412 1.742 3.510 0.010 18 0 "[ . 1 . 2]" 1
199 2 30 GLN QB 2 34 LEU QD 5.000 . 5.000 3.946 2.670 4.783 . 0 0 "[ . 1 . 2]" 1
200 2 30 GLN QG 2 34 LEU QD 5.000 . 5.000 2.797 1.853 4.831 . 0 0 "[ . 1 . 2]" 1
201 2 31 TRP HA 2 34 LEU QD 5.000 . 5.000 3.596 1.768 4.171 . 0 0 "[ . 1 . 2]" 1
202 2 34 LEU H 2 34 LEU QD 3.500 . 3.500 2.906 2.258 3.335 . 0 0 "[ . 1 . 2]" 1
203 2 34 LEU QD 2 35 LEU H 5.000 . 5.000 3.629 3.366 3.902 . 0 0 "[ . 1 . 2]" 1
204 2 31 TRP HA 2 34 LEU HG 5.000 . 5.000 3.835 3.184 4.444 . 0 0 "[ . 1 . 2]" 1
205 2 34 LEU H 2 34 LEU HG 5.000 . 5.000 4.347 4.165 4.605 . 0 0 "[ . 1 . 2]" 1
206 2 34 LEU HG 2 35 LEU H 5.000 . 5.000 4.720 4.409 4.973 . 0 0 "[ . 1 . 2]" 1
207 2 35 LEU HA 2 35 LEU QD 3.500 . 3.500 3.165 2.757 3.375 . 0 0 "[ . 1 . 2]" 1
208 2 35 LEU HA 2 36 GLN H 5.000 . 5.000 3.564 3.538 3.577 . 0 0 "[ . 1 . 2]" 1
209 2 35 LEU QB 2 36 GLN H . . 5.000 2.058 1.920 2.546 . 0 0 "[ . 1 . 2]" 1
210 1 70 LEU QD 2 35 LEU QD 3.500 . 3.500 2.237 1.633 3.511 0.011 15 0 "[ . 1 . 2]" 1
211 2 35 LEU H 2 35 LEU QD 5.000 . 5.000 2.217 1.918 2.930 . 0 0 "[ . 1 . 2]" 1
212 2 35 LEU QD 2 36 GLN H 5.000 . 5.000 2.460 1.817 3.037 . 0 0 "[ . 1 . 2]" 1
213 1 70 LEU QD 2 35 LEU HG 5.000 . 5.000 3.184 1.872 5.097 0.097 15 0 "[ . 1 . 2]" 1
214 2 35 LEU H 2 35 LEU HG 5.000 . 5.000 2.160 1.841 2.414 . 0 0 "[ . 1 . 2]" 1
215 2 35 LEU HG 2 36 GLN H 6.000 . 6.000 3.698 1.938 4.128 . 0 0 "[ . 1 . 2]" 1
216 2 36 GLN HA 2 36 GLN QG 3.500 . 3.500 3.036 2.499 3.306 . 0 0 "[ . 1 . 2]" 1
217 2 36 GLN HA 2 37 THR H 3.500 . 3.500 3.455 2.893 3.518 0.018 5 0 "[ . 1 . 2]" 1
218 2 36 GLN H 2 36 GLN QB 3.500 . 3.500 2.490 2.171 2.975 . 0 0 "[ . 1 . 2]" 1
219 2 36 GLN QB 2 37 THR MG 5.000 . 5.000 3.924 2.824 4.420 . 0 0 "[ . 1 . 2]" 1
220 2 36 GLN QB 2 37 THR H 5.000 . 5.000 1.907 1.731 2.016 . 0 0 "[ . 1 . 2]" 1
221 2 36 GLN H 2 36 GLN QG 5.000 . 5.000 3.262 1.852 4.045 . 0 0 "[ . 1 . 2]" 1
222 2 36 GLN QG 2 37 THR H 6.000 . 6.000 2.174 1.867 3.502 . 0 0 "[ . 1 . 2]" 1
223 2 37 THR HA 2 37 THR MG 3.500 . 3.500 2.431 2.111 3.202 . 0 0 "[ . 1 . 2]" 1
224 2 37 THR HB 2 38 SER H 5.000 . 5.000 3.691 3.104 4.636 . 0 0 "[ . 1 . 2]" 1
225 2 36 GLN QG 2 37 THR MG 5.000 . 5.000 3.681 2.334 4.853 . 0 0 "[ . 1 . 2]" 1
226 2 37 THR H 2 37 THR MG 3.500 . 3.500 3.290 2.738 3.571 0.071 2 0 "[ . 1 . 2]" 1
227 2 37 THR MG 2 38 SER H 5.000 . 5.000 3.971 2.373 4.397 . 0 0 "[ . 1 . 2]" 1
228 2 38 SER QB 2 39 ASN H 5.000 . 5.000 2.832 2.017 3.822 . 0 0 "[ . 1 . 2]" 1
229 2 39 ASN QB 2 40 ILE H 5.000 . 5.000 3.101 1.915 4.050 . 0 0 "[ . 1 . 2]" 1
230 2 40 ILE HA 2 40 ILE MD 3.500 . 3.500 2.670 1.925 3.402 . 0 0 "[ . 1 . 2]" 1
231 2 40 ILE HA 2 41 THR H 3.500 . 3.500 2.238 2.194 2.267 . 0 0 "[ . 1 . 2]" 1
232 2 40 ILE HB 2 40 ILE MD 3.500 . 3.500 2.788 2.020 3.230 . 0 0 "[ . 1 . 2]" 1
233 2 40 ILE H 2 40 ILE HB 3.500 . 3.500 3.349 2.627 3.597 0.097 7 0 "[ . 1 . 2]" 1
234 2 40 ILE HB 2 41 THR H 5.000 . 5.000 4.291 3.976 4.586 . 0 0 "[ . 1 . 2]" 1
235 2 40 ILE H 2 40 ILE MD 5.000 . 5.000 3.155 1.807 4.291 . 0 0 "[ . 1 . 2]" 1
236 2 40 ILE MD 2 41 THR HA 5.000 . 5.000 4.307 3.808 5.065 0.065 5 0 "[ . 1 . 2]" 1
237 2 40 ILE H 2 40 ILE QG 5.000 . 5.000 3.549 1.897 4.289 . 0 0 "[ . 1 . 2]" 1
238 2 40 ILE QG 2 41 THR H 5.000 . 5.000 4.345 3.449 4.956 . 0 0 "[ . 1 . 2]" 1
239 2 40 ILE HA 2 40 ILE MG 3.500 . 3.500 2.788 2.059 3.209 . 0 0 "[ . 1 . 2]" 1
240 2 40 ILE MG 2 41 THR H 5.000 . 5.000 4.163 3.976 4.257 . 0 0 "[ . 1 . 2]" 1
241 2 41 THR HA 2 41 THR MG 3.500 . 3.500 2.434 2.016 3.228 . 0 0 "[ . 1 . 2]" 1
242 2 41 THR HA 2 42 LYS H 3.500 . 3.500 3.255 2.263 3.560 0.060 16 0 "[ . 1 . 2]" 1
243 2 41 THR HB 2 42 LYS H 5.000 . 5.000 3.241 2.053 4.661 . 0 0 "[ . 1 . 2]" 1
244 2 42 LYS HA 2 42 LYS QG 3.500 . 3.500 2.394 2.019 3.344 . 0 0 "[ . 1 . 2]" 1
245 2 42 LYS HA 2 42 LYS QD 5.000 . 5.000 3.810 2.718 4.463 . 0 0 "[ . 1 . 2]" 1
246 2 42 LYS H 2 42 LYS QG 5.000 . 5.000 3.731 2.314 4.279 . 0 0 "[ . 1 . 2]" 1
247 1 1 MET ME 1 43 THR MG 5.000 . 5.000 4.690 4.191 4.990 . 0 0 "[ . 1 . 2]" 1
248 1 3 THR HA 1 4 ILE H 5.000 . 5.000 2.227 2.136 2.465 . 0 0 "[ . 1 . 2]" 1
249 1 3 THR H 1 3 THR HB . . 3.500 3.052 2.512 3.512 0.012 16 0 "[ . 1 . 2]" 1
250 1 3 THR MG 1 4 ILE H 5.000 . 5.000 3.156 2.163 4.253 . 0 0 "[ . 1 . 2]" 1
251 1 4 ILE MD 1 46 ILE MD 5.000 . 5.000 4.469 2.978 5.023 0.023 6 0 "[ . 1 . 2]" 1
252 1 4 ILE MD 1 176 ALA MB 5.000 . 5.000 2.265 1.678 3.830 . 0 0 "[ . 1 . 2]" 1
253 1 4 ILE MG 1 5 LYS H 5.000 . 5.000 2.865 1.937 3.944 . 0 0 "[ . 1 . 2]" 1
254 1 4 ILE MG 1 76 ASP QB 5.000 . 5.000 2.740 1.800 4.182 . 0 0 "[ . 1 . 2]" 1
255 1 4 ILE MG 1 176 ALA MB 3.500 . 3.500 2.009 1.668 2.984 . 0 0 "[ . 1 . 2]" 1
256 1 5 LYS HA 1 6 CYS H 5.000 . 5.000 2.210 2.143 2.354 . 0 0 "[ . 1 . 2]" 1
257 1 6 CYS HA 1 7 VAL H 5.000 . 5.000 2.201 2.144 2.324 . 0 0 "[ . 1 . 2]" 1
258 1 7 VAL QG 1 78 PHE QD 5.000 . 5.000 3.730 2.712 5.084 0.084 20 0 "[ . 1 . 2]" 1
259 1 8 VAL QG 1 79 LEU QD 5.000 . 5.000 2.953 1.862 3.789 . 0 0 "[ . 1 . 2]" 1
260 1 9 VAL QG 1 80 VAL HA 5.000 . 5.000 3.849 2.226 5.011 0.011 14 0 "[ . 1 . 2]" 1
261 1 9 VAL QG 1 101 ILE MG 5.000 . 5.000 3.670 1.792 5.022 0.022 10 0 "[ . 1 . 2]" 1
262 1 17 THR MG 1 21 ILE MD 5.000 . 5.000 3.840 1.852 5.056 0.056 19 0 "[ . 1 . 2]" 1
263 1 19 LEU H 1 19 LEU QB . . 3.500 2.160 2.031 2.330 . 0 0 "[ . 1 . 2]" 1
264 1 19 LEU QD 1 79 LEU QD . . 3.500 2.305 1.574 3.400 . 0 0 "[ . 1 . 2]" 1
265 1 19 LEU QD 1 113 VAL QG 5.000 . 5.000 2.640 1.640 4.415 . 0 0 "[ . 1 . 2]" 1
266 1 19 LEU QD 1 165 LEU QD 3.500 . 3.500 3.433 3.023 3.527 0.027 17 0 "[ . 1 . 2]" 1
267 1 19 LEU QD 1 168 VAL QG 5.000 . 5.000 2.997 2.284 3.589 . 0 0 "[ . 1 . 2]" 1
268 1 19 LEU QD 1 169 PHE HZ 5.000 . 5.000 4.440 2.989 5.057 0.057 13 0 "[ . 1 . 2]" 1
269 1 20 LEU QD 1 23 TYR QD 3.500 . 3.500 3.405 2.619 3.680 0.180 11 0 "[ . 1 . 2]" 1
270 1 20 LEU QD 1 40 TYR QE 5.000 . 5.000 3.307 2.427 4.154 . 0 0 "[ . 1 . 2]" 1
271 1 21 ILE HA 1 21 ILE MD . . 3.500 2.018 1.865 2.186 . 0 0 "[ . 1 . 2]" 1
272 1 21 ILE MD 1 21 ILE MG 3.500 . 3.500 3.010 2.176 3.258 . 0 0 "[ . 1 . 2]" 1
273 1 21 ILE H 1 21 ILE MD 5.000 . 5.000 2.168 1.898 2.716 . 0 0 "[ . 1 . 2]" 1
274 1 21 ILE MD 1 24 THR HB 5.000 . 5.000 5.182 5.027 5.374 0.374 19 0 "[ . 1 . 2]" 1
275 1 21 ILE MD 2 9 PHE QE 5.000 . 5.000 2.848 2.039 3.641 . 0 0 "[ . 1 . 2]" 1
276 1 23 TYR HA 1 165 LEU QD 5.000 . 5.000 1.987 1.782 3.038 . 0 0 "[ . 1 . 2]" 1
277 1 25 THR HA 1 25 THR MG . . 3.500 3.082 2.092 3.216 . 0 0 "[ . 1 . 2]" 1
278 1 26 ASN HA 1 27 LYS H 5.000 . 5.000 2.755 2.481 3.569 . 0 0 "[ . 1 . 2]" 1
279 1 27 LYS HA 1 28 PHE H . . 2.800 2.542 2.153 2.849 0.049 12 0 "[ . 1 . 2]" 1
280 1 27 LYS HA 1 27 LYS QD 5.000 . 5.000 4.031 3.507 4.290 . 0 0 "[ . 1 . 2]" 1
281 1 27 LYS H 1 27 LYS QG 5.000 . 5.000 3.094 2.413 4.238 . 0 0 "[ . 1 . 2]" 1
282 1 28 PHE QD 1 159 ALA MB 5.000 . 5.000 3.554 2.794 5.004 0.004 15 0 "[ . 1 . 2]" 1
283 1 28 PHE QD 1 160 LEU QD 5.000 . 5.000 3.633 2.740 3.994 . 0 0 "[ . 1 . 2]" 1
284 1 28 PHE QE 1 159 ALA MB 5.000 . 5.000 2.304 1.861 3.044 . 0 0 "[ . 1 . 2]" 1
285 1 29 PRO HA 1 30 SER H . . 2.800 2.234 2.157 2.426 . 0 0 "[ . 1 . 2]" 1
286 1 30 SER H 1 30 SER QB . . 3.500 2.678 2.332 3.459 . 0 0 "[ . 1 . 2]" 1
287 1 31 GLU H 1 31 GLU QB . . 3.500 2.515 2.065 3.329 . 0 0 "[ . 1 . 2]" 1
288 1 31 GLU H 1 31 GLU QG . . 3.500 2.725 1.917 3.586 0.086 9 0 "[ . 1 . 2]" 1
289 1 32 TYR QD 1 33 VAL H . . 3.500 2.255 2.076 2.724 . 0 0 "[ . 1 . 2]" 1
290 1 33 VAL HA 1 34 PRO QD 5.000 . 5.000 2.012 1.982 2.057 . 0 0 "[ . 1 . 2]" 1
291 1 33 VAL QG 1 34 PRO QD 5.000 . 5.000 1.907 1.788 3.036 . 0 0 "[ . 1 . 2]" 1
292 1 35 THR MG 1 38 ASP H 3.500 . 3.500 3.579 3.251 3.694 0.194 9 0 "[ . 1 . 2]" 1
293 1 36 VAL QG 1 37 PHE H 5.000 . 5.000 3.264 2.207 3.713 . 0 0 "[ . 1 . 2]" 1
294 1 41 ALA HA 1 42 VAL H . . 3.500 2.197 2.145 2.333 . 0 0 "[ . 1 . 2]" 1
295 1 41 ALA MB 1 42 VAL H . . 3.500 3.030 2.613 3.333 . 0 0 "[ . 1 . 2]" 1
296 1 42 VAL QG 2 7 SER H 5.000 . 5.000 3.952 3.332 4.608 . 0 0 "[ . 1 . 2]" 1
297 1 42 VAL QG 2 10 GLU H 5.000 . 5.000 4.711 4.436 5.033 0.033 12 0 "[ . 1 . 2]" 1
298 1 43 THR MG 1 45 MET ME 5.000 . 5.000 4.896 4.451 5.016 0.016 4 0 "[ . 1 . 2]" 1
299 1 43 THR MG 1 52 THR HA 5.000 . 5.000 4.188 3.422 4.983 . 0 0 "[ . 1 . 2]" 1
300 1 44 VAL QG 1 46 ILE MD 5.000 . 5.000 2.667 1.777 4.208 . 0 0 "[ . 1 . 2]" 1
301 1 45 MET HA 1 45 MET ME 5.000 . 5.000 4.519 4.094 4.902 . 0 0 "[ . 1 . 2]" 1
302 1 45 MET ME 1 45 MET QG 3.500 . 3.500 2.304 2.064 2.509 . 0 0 "[ . 1 . 2]" 1
303 1 45 MET ME 2 1 GLY QA 5.000 . 5.000 4.961 4.707 5.010 0.010 4 0 "[ . 1 . 2]" 1
304 1 45 MET H 1 45 MET QG 5.000 . 5.000 2.116 1.917 3.134 . 0 0 "[ . 1 . 2]" 1
305 1 46 ILE MD 1 51 TYR QD 5.000 . 5.000 3.293 1.987 5.025 0.025 11 0 "[ . 1 . 2]" 1
306 1 46 ILE MD 1 51 TYR QE 5.000 . 5.000 3.363 2.146 4.716 . 0 0 "[ . 1 . 2]" 1
307 1 46 ILE MD 1 46 ILE MG 3.500 . 3.500 2.206 1.903 3.168 . 0 0 "[ . 1 . 2]" 1
308 1 46 ILE MG 1 47 GLY H 5.000 . 5.000 3.234 2.265 4.117 . 0 0 "[ . 1 . 2]" 1
309 1 49 GLU HA 1 50 PRO QD 5.000 . 5.000 2.009 1.883 2.118 . 0 0 "[ . 1 . 2]" 1
310 1 51 TYR QE 1 177 LEU QD 5.000 . 5.000 3.034 1.925 4.139 . 0 0 "[ . 1 . 2]" 1
311 1 52 THR MG 1 53 LEU H 5.000 . 5.000 3.825 3.131 4.342 . 0 0 "[ . 1 . 2]" 1
312 1 6 CYS H 1 53 LEU QD 5.000 . 5.000 3.399 2.203 4.682 . 0 0 "[ . 1 . 2]" 1
313 1 53 LEU QD 1 169 PHE QD 5.000 . 5.000 4.435 3.473 5.017 0.017 12 0 "[ . 1 . 2]" 1
314 1 6 CYS H 1 55 LEU QD 5.000 . 5.000 3.971 2.505 4.979 . 0 0 "[ . 1 . 2]" 1
315 1 23 TYR QD 1 55 LEU QD 5.000 . 5.000 4.640 3.952 5.098 0.098 7 0 "[ . 1 . 2]" 1
316 1 56 PHE HA 1 57 ASP H . . 3.500 2.168 2.131 2.258 . 0 0 "[ . 1 . 2]" 1
317 1 7 VAL QG 1 58 THR MG 3.500 . 3.500 2.735 1.674 3.547 0.047 15 0 "[ . 1 . 2]" 1
318 1 61 LEU HA 1 61 LEU QD . . 3.500 2.482 1.901 3.423 . 0 0 "[ . 1 . 2]" 1
319 1 61 LEU HA 1 62 GLU H . . 3.500 2.855 2.132 3.561 0.061 1 0 "[ . 1 . 2]" 1
320 1 61 LEU QD 1 62 GLU H 5.000 . 5.000 3.212 1.941 4.188 . 0 0 "[ . 1 . 2]" 1
321 1 61 LEU QD 1 63 ASP H 5.000 . 5.000 3.997 2.514 5.046 0.046 14 0 "[ . 1 . 2]" 1
322 1 61 LEU QD 1 64 TYR QE 5.000 . 5.000 4.144 2.161 5.012 0.012 13 0 "[ . 1 . 2]" 1
323 1 62 GLU H 1 62 GLU QB . . 3.500 2.706 2.166 3.440 . 0 0 "[ . 1 . 2]" 1
324 1 62 GLU H 1 62 GLU QG 5.000 . 5.000 3.281 2.007 4.312 . 0 0 "[ . 1 . 2]" 1
325 1 62 GLU QG 1 63 ASP H 5.000 . 5.000 4.281 3.515 4.788 . 0 0 "[ . 1 . 2]" 1
326 1 63 ASP H 1 63 ASP QB . . 3.500 2.653 2.237 3.478 . 0 0 "[ . 1 . 2]" 1
327 1 66 ARG HA 1 66 ARG QG 3.500 . 3.500 2.786 2.238 3.346 . 0 0 "[ . 1 . 2]" 1
328 1 66 ARG H 1 66 ARG QB . . 3.500 2.552 2.080 2.906 . 0 0 "[ . 1 . 2]" 1
329 1 66 ARG QD 2 35 LEU QD 5.000 . 5.000 3.413 3.051 3.604 . 0 0 "[ . 1 . 2]" 1
330 1 66 ARG H 1 66 ARG QG . . 3.500 2.234 1.906 3.410 . 0 0 "[ . 1 . 2]" 1
331 1 67 LEU HA 1 67 LEU QD . . 3.500 2.638 1.881 3.068 . 0 0 "[ . 1 . 2]" 1
332 1 67 LEU HA 1 70 LEU QD 5.000 . 5.000 2.265 1.731 4.093 . 0 0 "[ . 1 . 2]" 1
333 1 67 LEU HA 2 35 LEU QD . . 3.500 2.285 1.855 2.915 . 0 0 "[ . 1 . 2]" 1
334 1 67 LEU H 1 67 LEU QB . . 3.500 2.322 2.154 2.660 . 0 0 "[ . 1 . 2]" 1
335 1 67 LEU QD 1 70 LEU QD . . 3.500 1.868 1.554 3.461 . 0 0 "[ . 1 . 2]" 1
336 1 67 LEU QD 2 28 PRO QB 5.000 . 5.000 5.048 4.321 5.218 0.218 15 0 "[ . 1 . 2]" 1
337 1 70 LEU H 1 70 LEU QD 5.000 . 5.000 2.421 1.789 3.314 . 0 0 "[ . 1 . 2]" 1
338 1 70 LEU QD 2 31 TRP HA 5.000 . 5.000 2.093 1.651 3.969 . 0 0 "[ . 1 . 2]" 1
339 1 70 LEU QD 2 31 TRP QB 5.000 . 5.000 2.673 2.203 3.642 . 0 0 "[ . 1 . 2]" 1
340 1 70 LEU H 1 70 LEU HG . . 3.500 2.298 1.878 3.750 0.250 17 0 "[ . 1 . 2]" 1
341 1 73 PRO HA 1 74 GLN H . . 3.500 3.515 3.452 3.563 0.063 18 0 "[ . 1 . 2]" 1
342 1 7 VAL QG 1 75 THR MG 5.000 . 5.000 2.359 1.636 3.800 . 0 0 "[ . 1 . 2]" 1
343 1 75 THR MG 1 77 VAL H 5.000 . 5.000 4.656 3.086 5.050 0.050 18 0 "[ . 1 . 2]" 1
344 1 75 THR MG 1 108 THR MG 5.000 . 5.000 4.414 3.410 5.015 0.015 16 0 "[ . 1 . 2]" 1
345 1 77 VAL HB 1 176 ALA MB 5.000 . 5.000 4.582 3.558 5.016 0.016 8 0 "[ . 1 . 2]" 1
346 1 6 CYS HA 1 77 VAL QG 5.000 . 5.000 4.024 3.192 5.059 0.059 14 0 "[ . 1 . 2]" 1
347 1 77 VAL QG 1 172 ALA HA 5.000 . 5.000 3.350 2.660 4.050 . 0 0 "[ . 1 . 2]" 1
348 1 78 PHE HA 1 79 LEU H 5.000 . 5.000 2.211 2.140 2.397 . 0 0 "[ . 1 . 2]" 1
349 1 78 PHE QD 1 80 VAL QG 5.000 . 5.000 3.558 1.987 4.847 . 0 0 "[ . 1 . 2]" 1
350 1 78 PHE QD 1 108 THR MG 5.000 . 5.000 3.855 1.911 5.014 0.014 2 0 "[ . 1 . 2]" 1
351 1 79 LEU QD 1 80 VAL H 5.000 . 5.000 2.664 1.930 4.193 . 0 0 "[ . 1 . 2]" 1
352 1 79 LEU QD 1 168 VAL QG 5.000 . 5.000 3.541 2.388 4.592 . 0 0 "[ . 1 . 2]" 1
353 1 80 VAL H 1 80 VAL QG . . 3.500 2.418 2.041 2.653 . 0 0 "[ . 1 . 2]" 1
354 1 80 VAL QG 1 81 CYS H 5.000 . 5.000 2.174 1.865 3.317 . 0 0 "[ . 1 . 2]" 1
355 1 80 VAL QG 1 101 ILE MD 3.500 . 3.500 2.415 1.521 3.470 . 0 0 "[ . 1 . 2]" 1
356 1 80 VAL QG 1 101 ILE MG 5.000 . 5.000 3.560 1.780 4.759 . 0 0 "[ . 1 . 2]" 1
357 1 81 CYS HA 1 82 PHE H . . 3.500 2.318 2.120 2.528 . 0 0 "[ . 1 . 2]" 1
358 1 82 PHE QD 1 84 VAL QG 5.000 . 5.000 3.444 2.552 5.190 0.190 13 0 "[ . 1 . 2]" 1
359 1 84 VAL QG 1 85 VAL H 5.000 . 5.000 3.162 1.861 3.748 . 0 0 "[ . 1 . 2]" 1
360 1 84 VAL QG 1 115 THR H 5.000 . 5.000 2.574 1.908 4.207 . 0 0 "[ . 1 . 2]" 1
361 1 85 VAL H 1 85 VAL QG . . 3.500 2.186 1.855 3.054 . 0 0 "[ . 1 . 2]" 1
362 1 85 VAL QG 1 120 ARG HA 5.000 . 5.000 2.313 1.757 3.769 . 0 0 "[ . 1 . 2]" 1
363 1 87 PRO HA 1 137 ILE MD . . 3.500 2.904 1.931 3.576 0.076 11 0 "[ . 1 . 2]" 1
364 1 88 SER HA 1 91 GLU H 5.000 . 5.000 4.405 3.806 4.786 . 0 0 "[ . 1 . 2]" 1
365 1 90 PHE QE 1 141 THR MG 5.000 . 5.000 3.216 2.210 3.706 . 0 0 "[ . 1 . 2]" 1
366 1 90 PHE QE 1 145 LEU QD 5.000 . 5.000 2.629 1.735 3.338 . 0 0 "[ . 1 . 2]" 1
367 1 91 GLU HA 1 91 GLU QG . . 3.500 2.344 2.016 3.334 . 0 0 "[ . 1 . 2]" 1
368 1 91 GLU H 1 91 GLU QB . . 3.500 2.248 2.048 2.593 . 0 0 "[ . 1 . 2]" 1
369 1 91 GLU H 1 91 GLU QG 3.500 . 3.500 2.760 1.952 3.504 0.004 7 0 "[ . 1 . 2]" 1
370 1 93 VAL H 1 93 VAL HB . . 3.500 2.890 2.502 3.608 0.108 19 0 "[ . 1 . 2]" 1
371 1 90 PHE HA 1 93 VAL QG 5.000 . 5.000 2.510 1.899 3.399 . 0 0 "[ . 1 . 2]" 1
372 1 93 VAL H 1 93 VAL QG . . 3.500 2.018 1.871 2.246 . 0 0 "[ . 1 . 2]" 1
373 1 93 VAL QG 1 94 LYS H 5.000 . 5.000 2.863 1.977 3.400 . 0 0 "[ . 1 . 2]" 1
374 1 93 VAL QG 1 145 LEU QD 5.000 . 5.000 4.321 3.473 4.773 . 0 0 "[ . 1 . 2]" 1
375 1 94 LYS HA 1 145 LEU QD 5.000 . 5.000 4.396 3.891 4.984 . 0 0 "[ . 1 . 2]" 1
376 1 94 LYS QB 1 145 LEU QD 5.000 . 5.000 3.511 2.939 3.926 . 0 0 "[ . 1 . 2]" 1
377 1 94 LYS HA 1 94 LYS QD 5.000 . 5.000 3.547 1.936 4.070 . 0 0 "[ . 1 . 2]" 1
378 1 94 LYS QD 1 145 LEU QD 3.500 . 3.500 2.363 1.753 3.258 . 0 0 "[ . 1 . 2]" 1
379 1 94 LYS HA 1 94 LYS QE 5.000 . 5.000 4.281 3.360 4.658 . 0 0 "[ . 1 . 2]" 1
380 1 94 LYS QE 1 94 LYS QG 3.500 . 3.500 2.191 1.919 2.833 . 0 0 "[ . 1 . 2]" 1
381 1 94 LYS QE 1 145 LEU QD 3.500 . 3.500 2.306 1.678 3.313 . 0 0 "[ . 1 . 2]" 1
382 1 94 LYS QG 1 145 LEU QD 3.500 . 3.500 2.494 1.900 3.317 . 0 0 "[ . 1 . 2]" 1
383 1 98 VAL QG 1 110 PHE QE 5.000 . 5.000 4.203 3.261 4.679 . 0 0 "[ . 1 . 2]" 1
384 1 98 VAL QG 1 110 PHE HZ 5.000 . 5.000 4.426 3.027 5.014 0.014 5 0 "[ . 1 . 2]" 1
385 1 98 VAL QG 1 112 LEU QD 3.500 . 3.500 3.187 2.630 3.559 0.059 17 0 "[ . 1 . 2]" 1
386 1 101 ILE MD 1 101 ILE MG 3.500 . 3.500 2.283 1.869 3.253 . 0 0 "[ . 1 . 2]" 1
387 1 101 ILE H 1 101 ILE MD 5.000 . 5.000 3.911 3.288 4.342 . 0 0 "[ . 1 . 2]" 1
388 1 101 ILE MD 1 110 PHE QB 5.000 . 5.000 2.297 1.731 3.245 . 0 0 "[ . 1 . 2]" 1
389 1 101 ILE MD 1 110 PHE QD 3.500 . 3.500 3.022 2.367 3.527 0.027 16 0 "[ . 1 . 2]" 1
390 1 101 ILE MG 1 110 PHE QD 5.000 . 5.000 3.344 1.820 4.987 . 0 0 "[ . 1 . 2]" 1
391 1 102 THR HA 1 102 THR MG . . 3.500 2.316 2.119 2.588 . 0 0 "[ . 1 . 2]" 1
392 1 101 ILE MD 1 102 THR MG 5.000 . 5.000 4.427 2.525 5.065 0.065 1 0 "[ . 1 . 2]" 1
393 1 102 THR MG 1 110 PHE QD 5.000 . 5.000 5.025 4.935 5.077 0.077 11 0 "[ . 1 . 2]" 1
394 1 103 HIS H 1 103 HIS QB . . 3.500 2.199 2.064 2.274 . 0 0 "[ . 1 . 2]" 1
395 1 103 HIS QB 1 103 HIS HD2 . . 3.500 2.676 2.636 2.809 . 0 0 "[ . 1 . 2]" 1
396 1 106 PRO HA 1 107 LYS H . . 3.500 3.176 2.147 3.567 0.067 17 0 "[ . 1 . 2]" 1
397 1 107 LYS HA 1 107 LYS QD 5.000 . 5.000 3.825 2.445 4.486 . 0 0 "[ . 1 . 2]" 1
398 1 107 LYS H 1 107 LYS QE 5.000 . 5.000 4.564 3.738 4.999 . 0 0 "[ . 1 . 2]" 1
399 1 107 LYS H 1 107 LYS QG 5.000 . 5.000 3.127 2.238 4.253 . 0 0 "[ . 1 . 2]" 1
400 1 109 PRO HA 1 110 PHE H . . 3.500 2.322 2.153 2.624 . 0 0 "[ . 1 . 2]" 1
401 1 111 LEU H 1 111 LEU QD 5.000 . 5.000 3.403 2.486 3.962 . 0 0 "[ . 1 . 2]" 1
402 1 111 LEU QD 1 112 LEU H 5.000 . 5.000 3.365 2.320 4.256 . 0 0 "[ . 1 . 2]" 1
403 1 111 LEU QD 1 153 LYS QB 5.000 . 5.000 4.569 3.834 5.020 0.020 10 0 "[ . 1 . 2]" 1
404 1 111 LEU QD 1 153 LYS H 5.000 . 5.000 3.558 2.478 4.156 . 0 0 "[ . 1 . 2]" 1
405 1 111 LEU QD 1 171 GLU HA 5.000 . 5.000 4.916 4.385 5.066 0.066 10 0 "[ . 1 . 2]" 1
406 1 111 LEU QD 1 172 ALA HA 3.500 . 3.500 2.504 1.937 3.208 . 0 0 "[ . 1 . 2]" 1
407 1 111 LEU QD 1 175 ALA MB 3.500 . 3.500 3.399 2.845 3.523 0.023 11 0 "[ . 1 . 2]" 1
408 1 80 VAL H 1 112 LEU HA 5.000 . 5.000 2.906 2.075 3.469 . 0 0 "[ . 1 . 2]" 1
409 1 82 PHE QD 1 112 LEU QD 5.000 . 5.000 3.098 1.746 4.295 . 0 0 "[ . 1 . 2]" 1
410 1 112 LEU QD 1 113 VAL H 5.000 . 5.000 3.648 2.354 4.420 . 0 0 "[ . 1 . 2]" 1
411 1 112 LEU QD 1 145 LEU QD 5.000 . 5.000 2.730 1.914 3.698 . 0 0 "[ . 1 . 2]" 1
412 1 112 LEU QD 1 146 ALA HA 5.000 . 5.000 3.118 2.198 4.106 . 0 0 "[ . 1 . 2]" 1
413 1 113 VAL QG 1 168 VAL QG . . 3.500 2.711 1.925 3.539 0.039 13 0 "[ . 1 . 2]" 1
414 1 117 ILE MD 1 117 ILE MG 3.500 . 3.500 2.002 1.849 2.516 . 0 0 "[ . 1 . 2]" 1
415 1 117 ILE H 1 117 ILE MD 5.000 . 5.000 3.601 3.058 4.001 . 0 0 "[ . 1 . 2]" 1
416 1 117 ILE MD 1 157 CYS HA 5.000 . 5.000 3.479 2.856 3.912 . 0 0 "[ . 1 . 2]" 1
417 1 117 ILE MD 1 163 LYS QE 5.000 . 5.000 4.169 2.744 4.936 . 0 0 "[ . 1 . 2]" 1
418 1 117 ILE MD 1 163 LYS QG 5.000 . 5.000 4.428 3.421 5.001 0.001 12 0 "[ . 1 . 2]" 1
419 1 117 ILE H 1 117 ILE MG . . 3.500 3.573 2.531 3.787 0.287 20 0 "[ . 1 . 2]" 1
420 1 117 ILE MG 1 118 ASP H 5.000 . 5.000 3.734 2.766 4.340 . 0 0 "[ . 1 . 2]" 1
421 1 119 LEU HA 1 119 LEU QD 3.500 . 3.500 2.386 1.836 3.145 . 0 0 "[ . 1 . 2]" 1
422 1 119 LEU H 1 119 LEU QD 5.000 . 5.000 3.388 2.185 3.724 . 0 0 "[ . 1 . 2]" 1
423 1 120 ARG H 1 120 ARG QB . . 3.500 2.370 2.230 2.790 . 0 0 "[ . 1 . 2]" 1
424 1 121 ASP H 1 121 ASP QB . . 3.500 2.564 2.080 3.500 0.000 7 0 "[ . 1 . 2]" 1
425 1 122 ASP HA 1 123 PRO QD 5.000 . 5.000 1.998 1.886 2.165 . 0 0 "[ . 1 . 2]" 1
426 1 123 PRO HA 1 126 ILE MD . . 3.500 2.669 1.841 3.563 0.063 2 0 "[ . 1 . 2]" 1
427 1 123 PRO HA 1 126 ILE H 5.000 . 5.000 4.014 3.462 4.779 . 0 0 "[ . 1 . 2]" 1
428 1 123 PRO QB 1 124 SER H . . 3.500 2.701 2.102 3.043 . 0 0 "[ . 1 . 2]" 1
429 1 124 SER HA 1 127 GLU QB 5.000 . 5.000 2.412 2.114 3.052 . 0 0 "[ . 1 . 2]" 1
430 1 124 SER H 1 124 SER QB . . 3.500 2.465 2.080 2.864 . 0 0 "[ . 1 . 2]" 1
431 1 125 THR HB 1 126 ILE H 5.000 . 5.000 2.612 1.952 4.013 . 0 0 "[ . 1 . 2]" 1
432 1 125 THR MG 1 126 ILE H 5.000 . 5.000 3.337 1.925 4.242 . 0 0 "[ . 1 . 2]" 1
433 1 126 ILE HA 1 126 ILE MG . . 3.500 2.402 2.339 2.428 . 0 0 "[ . 1 . 2]" 1
434 1 126 ILE HB 1 126 ILE MD . . 3.500 2.204 2.019 3.220 . 0 0 "[ . 1 . 2]" 1
435 1 126 ILE H 1 126 ILE HB . . 3.500 2.618 2.532 2.672 . 0 0 "[ . 1 . 2]" 1
436 1 121 ASP HA 1 126 ILE MD 5.000 . 5.000 3.566 2.328 5.003 0.003 1 0 "[ . 1 . 2]" 1
437 1 126 ILE H 1 126 ILE MD 3.500 . 3.500 2.042 1.885 2.789 . 0 0 "[ . 1 . 2]" 1
438 1 126 ILE H 1 126 ILE QG 5.000 . 5.000 2.529 1.994 2.811 . 0 0 "[ . 1 . 2]" 1
439 1 127 GLU H 1 127 GLU QB 3.500 . 3.500 2.106 2.045 2.296 . 0 0 "[ . 1 . 2]" 1
440 1 127 GLU QB 1 128 LYS H 5.000 . 5.000 2.364 2.040 2.860 . 0 0 "[ . 1 . 2]" 1
441 1 127 GLU H 1 127 GLU QG 5.000 . 5.000 3.600 2.603 4.003 . 0 0 "[ . 1 . 2]" 1
442 1 127 GLU QG 1 128 LYS H 5.000 . 5.000 4.109 3.073 4.498 . 0 0 "[ . 1 . 2]" 1
443 1 128 LYS H 1 128 LYS QB . . 2.800 2.271 2.252 2.302 . 0 0 "[ . 1 . 2]" 1
444 1 128 LYS H 1 128 LYS QE 5.000 . 5.000 4.607 3.943 5.008 0.008 18 0 "[ . 1 . 2]" 1
445 1 128 LYS H 1 128 LYS QG 5.000 . 5.000 3.971 3.937 4.021 . 0 0 "[ . 1 . 2]" 1
446 1 85 VAL HB 1 129 LEU QD 5.000 . 5.000 4.596 2.551 5.092 0.092 19 0 "[ . 1 . 2]" 1
447 1 126 ILE HA 1 129 LEU QD 5.000 . 5.000 2.623 2.075 3.658 . 0 0 "[ . 1 . 2]" 1
448 1 129 LEU HA 1 129 LEU QD 3.500 . 3.500 2.346 1.897 2.936 . 0 0 "[ . 1 . 2]" 1
449 1 129 LEU H 1 129 LEU QD 3.500 . 3.500 3.201 2.409 3.513 0.013 12 0 "[ . 1 . 2]" 1
450 1 129 LEU QD 1 130 ALA H 5.000 . 5.000 4.193 3.865 4.290 . 0 0 "[ . 1 . 2]" 1
451 1 129 LEU QD 1 136 PRO QD 5.000 . 5.000 2.871 1.780 3.991 . 0 0 "[ . 1 . 2]" 1
452 1 129 LEU H 1 129 LEU HG 5.000 . 5.000 3.605 2.201 4.570 . 0 0 "[ . 1 . 2]" 1
453 1 126 ILE MG 1 130 ALA MB 5.000 . 5.000 3.529 3.504 3.590 . 0 0 "[ . 1 . 2]" 1
454 1 127 GLU HA 1 130 ALA MB 3.500 . 3.500 3.531 3.490 3.553 0.053 17 0 "[ . 1 . 2]" 1
455 1 127 GLU QB 1 130 ALA MB 5.000 . 5.000 4.937 4.826 5.021 0.021 13 0 "[ . 1 . 2]" 1
456 1 130 ALA H 1 130 ALA MB 3.500 . 3.500 2.122 2.035 2.243 . 0 0 "[ . 1 . 2]" 1
457 1 130 ALA MB 1 131 LYS H 3.500 . 3.500 2.975 2.902 3.061 . 0 0 "[ . 1 . 2]" 1
458 1 131 LYS H 1 131 LYS QB . . 2.800 2.286 2.104 2.653 . 0 0 "[ . 1 . 2]" 1
459 1 131 LYS H 1 131 LYS QE 5.000 . 5.000 4.540 3.707 5.003 0.003 20 0 "[ . 1 . 2]" 1
460 1 128 LYS HA 1 131 LYS QG 5.000 . 5.000 3.819 2.343 5.017 0.017 18 0 "[ . 1 . 2]" 1
461 1 131 LYS QE 1 131 LYS QG 3.500 . 3.500 2.136 1.939 2.451 . 0 0 "[ . 1 . 2]" 1
462 1 131 LYS H 1 131 LYS QG 5.000 . 5.000 3.258 2.059 4.097 . 0 0 "[ . 1 . 2]" 1
463 1 132 ASN HA 1 133 LYS H 5.000 . 5.000 3.191 2.916 3.484 . 0 0 "[ . 1 . 2]" 1
464 1 132 ASN H 1 132 ASN QB 3.500 . 3.500 2.332 2.140 2.653 . 0 0 "[ . 1 . 2]" 1
465 1 132 ASN QB 1 133 LYS H 5.000 . 5.000 3.383 2.815 3.813 . 0 0 "[ . 1 . 2]" 1
466 1 133 LYS H 1 133 LYS QD . . 3.500 3.099 2.243 3.632 0.132 13 0 "[ . 1 . 2]" 1
467 1 133 LYS H 1 133 LYS QE 5.000 . 5.000 3.679 2.621 4.963 . 0 0 "[ . 1 . 2]" 1
468 1 133 LYS H 1 133 LYS QG 5.000 . 5.000 3.693 2.309 4.595 . 0 0 "[ . 1 . 2]" 1
469 1 135 LYS QB 1 136 PRO QD 5.000 . 5.000 3.146 1.990 3.855 . 0 0 "[ . 1 . 2]" 1
470 1 137 ILE HA 1 137 ILE MG . . 3.500 2.355 2.130 2.439 . 0 0 "[ . 1 . 2]" 1
471 1 137 ILE HA 1 138 THR H . . 3.500 2.153 2.126 2.183 . 0 0 "[ . 1 . 2]" 1
472 1 82 PHE QD 1 137 ILE MD 5.000 . 5.000 4.945 4.592 5.099 0.099 13 0 "[ . 1 . 2]" 1
473 1 90 PHE QB 1 137 ILE MD 5.000 . 5.000 2.965 2.498 4.351 . 0 0 "[ . 1 . 2]" 1
474 1 90 PHE QD 1 137 ILE MD 5.000 . 5.000 2.771 1.909 3.581 . 0 0 "[ . 1 . 2]" 1
475 1 132 ASN QB 1 137 ILE MD 5.000 . 5.000 5.032 4.983 5.071 0.071 4 0 "[ . 1 . 2]" 1
476 1 137 ILE HB 1 137 ILE MD 3.500 . 3.500 2.647 2.128 3.222 . 0 0 "[ . 1 . 2]" 1
477 1 137 ILE MD 1 137 ILE MG 3.500 . 3.500 2.025 1.815 3.145 . 0 0 "[ . 1 . 2]" 1
478 1 137 ILE H 1 137 ILE MD 5.000 . 5.000 3.506 1.871 4.005 . 0 0 "[ . 1 . 2]" 1
479 1 137 ILE MD 1 138 THR H 5.000 . 5.000 4.850 3.939 5.059 0.059 10 0 "[ . 1 . 2]" 1
480 1 137 ILE MD 1 141 THR MG 3.500 . 3.500 2.935 2.326 3.537 0.037 10 0 "[ . 1 . 2]" 1
481 1 82 PHE QD 1 137 ILE MG 5.000 . 5.000 4.746 4.062 5.056 0.056 12 0 "[ . 1 . 2]" 1
482 1 137 ILE MG 1 138 THR H 5.000 . 5.000 2.650 2.278 3.251 . 0 0 "[ . 1 . 2]" 1
483 1 137 ILE MG 1 141 THR MG 3.500 . 3.500 2.092 1.854 3.420 . 0 0 "[ . 1 . 2]" 1
484 1 137 ILE MG 1 142 ALA MB 3.500 . 3.500 3.452 2.921 3.547 0.047 16 0 "[ . 1 . 2]" 1
485 1 138 THR H 1 138 THR MG 3.500 . 3.500 2.333 1.916 2.983 . 0 0 "[ . 1 . 2]" 1
486 1 138 THR MG 1 140 GLU H 5.000 . 5.000 4.038 2.969 4.239 . 0 0 "[ . 1 . 2]" 1
487 1 139 PRO QB 1 140 GLU H 5.000 . 5.000 2.960 2.815 3.177 . 0 0 "[ . 1 . 2]" 1
488 1 140 GLU H 1 140 GLU QB . . 3.500 2.318 2.078 2.765 . 0 0 "[ . 1 . 2]" 1
489 1 140 GLU H 1 140 GLU QG 5.000 . 5.000 3.176 1.934 4.106 . 0 0 "[ . 1 . 2]" 1
490 1 141 THR HA 1 141 THR MG . . 3.500 2.348 2.045 2.463 . 0 0 "[ . 1 . 2]" 1
491 1 141 THR H 1 141 THR HB . . 3.500 2.660 2.524 3.107 . 0 0 "[ . 1 . 2]" 1
492 1 90 PHE QE 1 142 ALA HA 5.000 . 5.000 3.761 2.437 4.484 . 0 0 "[ . 1 . 2]" 1
493 1 82 PHE QD 1 142 ALA MB 5.000 . 5.000 4.297 3.754 5.024 0.024 10 0 "[ . 1 . 2]" 1
494 1 90 PHE HZ 1 142 ALA MB 5.000 . 5.000 3.612 2.415 4.321 . 0 0 "[ . 1 . 2]" 1
495 1 112 LEU QD 1 142 ALA MB 5.000 . 5.000 4.540 3.145 5.030 0.030 6 0 "[ . 1 . 2]" 1
496 1 139 PRO HA 1 142 ALA MB 5.000 . 5.000 3.545 2.915 4.124 . 0 0 "[ . 1 . 2]" 1
497 1 142 ALA H 1 142 ALA MB 3.500 . 3.500 2.145 2.030 2.237 . 0 0 "[ . 1 . 2]" 1
498 1 142 ALA MB 1 143 GLU H 5.000 . 5.000 2.476 2.124 2.731 . 0 0 "[ . 1 . 2]" 1
499 1 142 ALA MB 1 145 LEU H 5.000 . 5.000 4.734 4.462 5.024 0.024 11 0 "[ . 1 . 2]" 1
500 1 143 GLU HA 1 146 ALA MB 5.000 . 5.000 2.524 2.018 3.135 . 0 0 "[ . 1 . 2]" 1
501 1 140 GLU HA 1 143 GLU QB 5.000 . 5.000 2.929 2.439 3.258 . 0 0 "[ . 1 . 2]" 1
502 1 143 GLU H 1 143 GLU QB . . 3.500 2.214 2.065 2.624 . 0 0 "[ . 1 . 2]" 1
503 1 143 GLU QB 1 144 LYS H 5.000 . 5.000 2.625 2.399 2.873 . 0 0 "[ . 1 . 2]" 1
504 1 143 GLU H 1 143 GLU QG 5.000 . 5.000 3.596 1.945 3.999 . 0 0 "[ . 1 . 2]" 1
505 1 144 LYS H 1 144 LYS QB . . 3.500 2.130 2.041 2.376 . 0 0 "[ . 1 . 2]" 1
506 1 144 LYS H 1 144 LYS QD 5.000 . 5.000 4.349 3.449 4.752 . 0 0 "[ . 1 . 2]" 1
507 1 144 LYS H 1 144 LYS QG 5.000 . 5.000 3.484 2.521 4.050 . 0 0 "[ . 1 . 2]" 1
508 1 145 LEU HA 1 145 LEU QD 3.500 . 3.500 2.479 2.022 3.104 . 0 0 "[ . 1 . 2]" 1
509 1 145 LEU H 1 145 LEU QD 5.000 . 5.000 3.629 3.410 3.752 . 0 0 "[ . 1 . 2]" 1
510 1 145 LEU QD 1 146 ALA H 5.000 . 5.000 3.708 2.962 4.172 . 0 0 "[ . 1 . 2]" 1
511 1 145 LEU QD 1 148 ASP QB 5.000 . 5.000 3.414 2.650 4.190 . 0 0 "[ . 1 . 2]" 1
512 1 112 LEU HG 1 146 ALA MB 5.000 . 5.000 4.311 2.995 5.045 0.045 3 0 "[ . 1 . 2]" 1
513 1 146 ALA H 1 146 ALA MB 3.500 . 3.500 2.122 2.031 2.236 . 0 0 "[ . 1 . 2]" 1
514 1 146 ALA MB 1 147 ARG H 3.500 . 3.500 2.665 2.222 2.934 . 0 0 "[ . 1 . 2]" 1
515 1 146 ALA MB 1 151 ALA MB 3.500 . 3.500 3.347 2.781 3.674 0.174 11 0 "[ . 1 . 2]" 1
516 1 146 ALA MB 1 154 TYR QB 5.000 . 5.000 4.384 2.277 5.066 0.066 6 0 "[ . 1 . 2]" 1
517 1 147 ARG QB 1 148 ASP H . . 3.500 2.649 2.352 3.466 . 0 0 "[ . 1 . 2]" 1
518 1 147 ARG H 1 147 ARG QG 5.000 . 5.000 3.785 2.144 4.012 . 0 0 "[ . 1 . 2]" 1
519 1 148 ASP H 1 148 ASP HA . . 2.800 2.790 2.719 2.837 0.037 11 0 "[ . 1 . 2]" 1
520 1 148 ASP H 1 148 ASP QB . . 3.500 2.187 2.047 2.474 . 0 0 "[ . 1 . 2]" 1
521 1 149 LEU HA 1 149 LEU QD 3.500 . 3.500 3.347 3.001 3.420 . 0 0 "[ . 1 . 2]" 1
522 1 149 LEU H 1 149 LEU QD 5.000 . 5.000 2.838 1.665 3.210 . 0 0 "[ . 1 . 2]" 1
523 1 149 LEU QD 1 150 LYS H 5.000 . 5.000 2.816 2.182 3.497 . 0 0 "[ . 1 . 2]" 1
524 1 150 LYS HA 1 151 ALA H . . 3.500 2.679 2.136 3.562 0.062 3 0 "[ . 1 . 2]" 1
525 1 150 LYS H 1 150 LYS QG 5.000 . 5.000 3.744 2.648 4.398 . 0 0 "[ . 1 . 2]" 1
526 1 151 ALA HA 1 152 VAL H . . 3.500 2.693 2.528 2.850 . 0 0 "[ . 1 . 2]" 1
527 1 146 ALA HA 1 151 ALA MB 5.000 . 5.000 3.847 3.226 4.656 . 0 0 "[ . 1 . 2]" 1
528 1 151 ALA H 1 151 ALA MB 3.500 . 3.500 2.740 2.268 2.929 . 0 0 "[ . 1 . 2]" 1
529 1 151 ALA MB 1 152 VAL H 5.000 . 5.000 1.993 1.886 2.193 . 0 0 "[ . 1 . 2]" 1
530 1 111 LEU QD 1 152 VAL HB 5.000 . 5.000 2.245 1.863 3.550 . 0 0 "[ . 1 . 2]" 1
531 1 110 PHE H 1 152 VAL QG . . 3.500 3.385 2.907 3.560 0.060 5 0 "[ . 1 . 2]" 1
532 1 152 VAL H 1 152 VAL QG . . 3.500 2.131 1.986 2.364 . 0 0 "[ . 1 . 2]" 1
533 1 152 VAL QG 1 153 LYS H 5.000 . 5.000 3.209 1.826 3.614 . 0 0 "[ . 1 . 2]" 1
534 1 152 VAL QG 1 175 ALA MB 3.500 . 3.500 2.346 1.742 2.888 . 0 0 "[ . 1 . 2]" 1
535 1 149 LEU QD 1 153 LYS HA 5.000 . 5.000 5.020 4.923 5.270 0.270 11 0 "[ . 1 . 2]" 1
536 1 153 LYS HA 1 153 LYS QD 5.000 . 5.000 3.474 2.237 4.284 . 0 0 "[ . 1 . 2]" 1
537 1 153 LYS HA 1 154 TYR H . . 3.500 2.231 2.124 2.380 . 0 0 "[ . 1 . 2]" 1
538 1 153 LYS QB 1 154 TYR H 5.000 . 5.000 3.066 2.508 3.602 . 0 0 "[ . 1 . 2]" 1
539 1 153 LYS QD 1 155 VAL QG . . 3.500 2.721 2.130 3.542 0.042 13 0 "[ . 1 . 2]" 1
540 1 155 VAL HB 1 156 GLU H 5.000 . 5.000 3.436 3.155 4.229 . 0 0 "[ . 1 . 2]" 1
541 1 155 VAL H 1 155 VAL QG . . 3.500 2.289 1.911 2.646 . 0 0 "[ . 1 . 2]" 1
542 1 155 VAL QG 1 156 GLU H 5.000 . 5.000 3.442 2.693 3.583 . 0 0 "[ . 1 . 2]" 1
543 1 155 VAL QG 1 168 VAL HA 5.000 . 5.000 3.255 2.660 4.544 . 0 0 "[ . 1 . 2]" 1
544 1 155 VAL QG 1 168 VAL QG . . 3.500 2.835 2.016 3.571 0.071 20 0 "[ . 1 . 2]" 1
545 1 156 GLU HA 1 157 CYS H 5.000 . 5.000 2.418 2.090 2.597 . 0 0 "[ . 1 . 2]" 1
546 1 159 ALA HA 1 165 LEU QD 5.000 . 5.000 4.564 4.221 5.202 0.202 15 0 "[ . 1 . 2]" 1
547 1 159 ALA MB 1 165 LEU QD 5.000 . 5.000 5.056 4.906 5.179 0.179 12 0 "[ . 1 . 2]" 1
548 1 160 LEU HA 1 160 LEU QD . . 3.500 2.346 1.927 3.336 . 0 0 "[ . 1 . 2]" 1
549 1 28 PHE QB 1 160 LEU QD 5.000 . 5.000 4.887 3.950 5.243 0.243 11 0 "[ . 1 . 2]" 1
550 1 28 PHE QE 1 160 LEU QD 5.000 . 5.000 2.354 1.866 2.888 . 0 0 "[ . 1 . 2]" 1
551 1 160 LEU H 1 160 LEU QD 5.000 . 5.000 2.250 1.680 3.319 . 0 0 "[ . 1 . 2]" 1
552 1 160 LEU QD 1 161 THR H 5.000 . 5.000 3.561 2.924 4.200 . 0 0 "[ . 1 . 2]" 1
553 1 161 THR HA 1 161 THR MG . . 3.500 2.202 1.989 2.533 . 0 0 "[ . 1 . 2]" 1
554 1 118 ASP QB 1 161 THR MG 5.000 . 5.000 4.892 4.430 5.042 0.042 16 0 "[ . 1 . 2]" 1
555 1 160 LEU QD 1 161 THR MG 5.000 . 5.000 4.112 3.142 4.905 . 0 0 "[ . 1 . 2]" 1
556 1 163 LYS H 1 163 LYS QB . . 3.500 2.350 2.202 2.829 . 0 0 "[ . 1 . 2]" 1
557 1 23 TYR H 1 165 LEU QD 5.000 . 5.000 3.922 3.587 4.378 . 0 0 "[ . 1 . 2]" 1
558 1 165 LEU H 1 165 LEU QD 5.000 . 5.000 2.713 1.858 3.325 . 0 0 "[ . 1 . 2]" 1
559 1 167 ASN H 1 167 ASN QB 3.500 . 3.500 2.357 2.088 2.671 . 0 0 "[ . 1 . 2]" 1
560 1 168 VAL HA 1 171 GLU QB 5.000 . 5.000 3.058 2.349 4.229 . 0 0 "[ . 1 . 2]" 1
561 1 168 VAL H 1 168 VAL HB . . 3.500 2.572 2.451 2.693 . 0 0 "[ . 1 . 2]" 1
562 1 168 VAL H 1 168 VAL QG . . 3.500 2.117 1.880 2.411 . 0 0 "[ . 1 . 2]" 1
563 1 168 VAL QG 1 169 PHE H 5.000 . 5.000 2.305 1.833 3.147 . 0 0 "[ . 1 . 2]" 1
564 1 169 PHE HA 1 172 ALA MB 5.000 . 5.000 2.369 1.951 3.125 . 0 0 "[ . 1 . 2]" 1
565 1 171 GLU HA 1 174 LEU QB 5.000 . 5.000 2.654 1.988 3.857 . 0 0 "[ . 1 . 2]" 1
566 1 79 LEU QD 1 172 ALA MB 3.500 . 3.500 3.053 2.563 3.543 0.043 4 0 "[ . 1 . 2]" 1
567 1 111 LEU QD 1 172 ALA MB 3.500 . 3.500 2.449 1.767 3.438 . 0 0 "[ . 1 . 2]" 1
568 1 172 ALA H 1 172 ALA MB 3.500 . 3.500 2.186 2.073 2.307 . 0 0 "[ . 1 . 2]" 1
569 1 172 ALA MB 1 173 ILE H 5.000 . 5.000 2.720 2.308 2.991 . 0 0 "[ . 1 . 2]" 1
570 1 173 ILE HB 1 173 ILE MD 3.500 . 3.500 2.867 2.023 3.226 . 0 0 "[ . 1 . 2]" 1
571 1 173 ILE H 1 173 ILE MD 5.000 . 5.000 3.294 1.842 3.793 . 0 0 "[ . 1 . 2]" 1
572 1 46 ILE MD 1 173 ILE MG 5.000 . 5.000 1.928 1.618 2.480 . 0 0 "[ . 1 . 2]" 1
573 1 173 ILE MG 1 174 LEU H 5.000 . 5.000 3.454 2.916 3.892 . 0 0 "[ . 1 . 2]" 1
574 1 174 LEU HA 1 174 LEU QD 3.500 . 3.500 2.469 1.884 3.163 . 0 0 "[ . 1 . 2]" 1
575 1 171 GLU HA 1 174 LEU QD 5.000 . 5.000 3.480 2.560 4.738 . 0 0 "[ . 1 . 2]" 1
576 1 174 LEU H 1 174 LEU QD . . 3.500 3.473 2.805 3.609 0.109 7 0 "[ . 1 . 2]" 1
577 1 174 LEU QD 1 175 ALA H 5.000 . 5.000 3.650 2.407 4.295 . 0 0 "[ . 1 . 2]" 1
578 1 174 LEU H 1 174 LEU HG 5.000 . 5.000 4.442 3.885 4.604 . 0 0 "[ . 1 . 2]" 1
579 1 77 VAL HB 1 175 ALA MB 5.000 . 5.000 3.225 2.098 4.545 . 0 0 "[ . 1 . 2]" 1
580 1 172 ALA HA 1 175 ALA MB 5.000 . 5.000 3.125 2.427 3.821 . 0 0 "[ . 1 . 2]" 1
581 1 175 ALA H 1 175 ALA MB 3.500 . 3.500 2.157 2.037 2.238 . 0 0 "[ . 1 . 2]" 1
582 1 76 ASP QB 1 176 ALA MB 5.000 . 5.000 3.190 2.119 3.798 . 0 0 "[ . 1 . 2]" 1
583 1 77 VAL QG 1 176 ALA MB 5.000 . 5.000 3.400 2.851 4.047 . 0 0 "[ . 1 . 2]" 1
584 1 173 ILE HA 1 176 ALA MB 5.000 . 5.000 3.396 2.495 4.056 . 0 0 "[ . 1 . 2]" 1
585 1 176 ALA H 1 176 ALA MB 3.500 . 3.500 2.177 2.055 2.276 . 0 0 "[ . 1 . 2]" 1
586 1 177 LEU HA 1 177 LEU QD 3.500 . 3.500 2.699 2.144 3.426 . 0 0 "[ . 1 . 2]" 1
587 1 46 ILE MD 1 177 LEU QD 5.000 . 5.000 2.625 1.761 4.171 . 0 0 "[ . 1 . 2]" 1
588 1 177 LEU H 1 177 LEU QD 5.000 . 5.000 3.322 2.353 3.753 . 0 0 "[ . 1 . 2]" 1
589 1 178 GLU H 1 178 GLU QB 3.500 . 3.500 2.559 2.051 3.346 . 0 0 "[ . 1 . 2]" 1
590 1 178 GLU H 1 178 GLU QG 5.000 . 5.000 3.402 2.104 4.292 . 0 0 "[ . 1 . 2]" 1
591 1 179 PRO QB 1 180 PRO QD 5.000 . 5.000 2.614 1.902 3.521 . 0 0 "[ . 1 . 2]" 1
592 1 178 GLU HA 1 179 PRO QD 3.500 . 3.500 2.494 1.888 3.522 0.022 20 0 "[ . 1 . 2]" 1
593 1 180 PRO HA 1 181 GLU H . . 2.800 2.280 2.150 2.513 . 0 0 "[ . 1 . 2]" 1
594 1 180 PRO QB 1 181 GLU H 5.000 . 5.000 2.921 2.351 3.706 . 0 0 "[ . 1 . 2]" 1
595 1 179 PRO HA 1 180 PRO QD 3.500 . 3.500 2.066 1.898 2.240 . 0 0 "[ . 1 . 2]" 1
596 1 181 GLU HA 1 181 GLU QG 3.500 . 3.500 2.570 2.044 3.372 . 0 0 "[ . 1 . 2]" 1
597 1 181 GLU HA 1 182 PRO QD 3.500 . 3.500 2.582 1.932 3.513 0.013 20 0 "[ . 1 . 2]" 1
598 1 181 GLU H 1 181 GLU QB . . 2.800 2.396 2.045 2.867 0.067 13 0 "[ . 1 . 2]" 1
599 1 182 PRO HA 1 182 PRO QG 3.500 . 3.500 3.157 2.851 3.506 0.006 5 0 "[ . 1 . 2]" 1
600 1 182 PRO HA 1 183 LYS H . . 2.800 2.310 2.149 2.675 . 0 0 "[ . 1 . 2]" 1
601 1 183 LYS HA 1 184 LYS H . . 2.800 2.297 2.137 2.605 . 0 0 "[ . 1 . 2]" 1
602 1 183 LYS H 1 183 LYS QB . . 3.500 2.299 2.074 2.633 . 0 0 "[ . 1 . 2]" 1
603 1 183 LYS H 1 183 LYS QG 5.000 . 5.000 3.438 1.975 4.108 . 0 0 "[ . 1 . 2]" 1
604 1 184 LYS H 1 184 LYS QB . . 3.500 2.645 2.113 3.282 . 0 0 "[ . 1 . 2]" 1
605 1 184 LYS H 1 184 LYS QG 5.000 . 5.000 3.477 2.043 4.342 . 0 0 "[ . 1 . 2]" 1
606 1 2 GLN HA 1 3 THR H 3.500 . 3.500 2.234 2.139 2.693 . 0 0 "[ . 1 . 2]" 1
607 1 2 GLN QB 1 3 THR H 5.000 . 5.000 3.360 2.246 3.932 . 0 0 "[ . 1 . 2]" 1
608 1 2 GLN QG 1 3 THR H 5.000 . 5.000 2.988 1.993 4.217 . 0 0 "[ . 1 . 2]" 1
609 1 3 THR HB 1 4 ILE H 5.000 . 5.000 3.676 2.700 4.297 . 0 0 "[ . 1 . 2]" 1
610 1 4 ILE HA 1 5 LYS H 3.500 . 3.500 2.193 2.143 2.317 . 0 0 "[ . 1 . 2]" 1
611 1 4 ILE HB 1 5 LYS H 5.000 . 5.000 3.716 2.837 4.389 . 0 0 "[ . 1 . 2]" 1
612 1 4 ILE QG 1 5 LYS H 5.000 . 5.000 4.333 4.137 4.828 . 0 0 "[ . 1 . 2]" 1
613 1 5 LYS H 1 76 ASP QB 5.000 . 5.000 3.083 2.038 4.026 . 0 0 "[ . 1 . 2]" 1
614 1 7 VAL H 1 75 THR MG 5.000 . 5.000 3.459 2.488 4.873 . 0 0 "[ . 1 . 2]" 1
615 1 7 VAL HA 1 8 VAL H 5.000 . 5.000 2.278 2.133 2.371 . 0 0 "[ . 1 . 2]" 1
616 1 7 VAL QG 1 8 VAL H 5.000 . 5.000 2.171 1.834 3.226 . 0 0 "[ . 1 . 2]" 1
617 1 8 VAL HA 1 9 VAL H 5.000 . 5.000 2.310 2.152 2.463 . 0 0 "[ . 1 . 2]" 1
618 1 8 VAL QG 1 9 VAL H 5.000 . 5.000 2.480 1.857 3.490 . 0 0 "[ . 1 . 2]" 1
619 1 9 VAL HA 1 10 GLY H 5.000 . 5.000 2.179 2.145 2.334 . 0 0 "[ . 1 . 2]" 1
620 1 9 VAL HB 1 10 GLY H 5.000 . 5.000 3.894 2.584 4.302 . 0 0 "[ . 1 . 2]" 1
621 1 9 VAL QG 1 10 GLY H 5.000 . 5.000 2.763 1.978 3.615 . 0 0 "[ . 1 . 2]" 1
622 1 10 GLY QA 1 11 ASP H 5.000 . 5.000 2.235 2.113 2.285 . 0 0 "[ . 1 . 2]" 1
623 1 11 ASP H 1 97 TRP HE1 5.000 . 5.000 3.124 2.256 4.624 . 0 0 "[ . 1 . 2]" 1
624 1 11 ASP HA 1 12 GLY H 3.500 . 3.500 2.729 2.141 3.565 0.065 14 0 "[ . 1 . 2]" 1
625 1 11 ASP QB 1 12 GLY H 5.000 . 5.000 3.103 1.957 3.910 . 0 0 "[ . 1 . 2]" 1
626 1 12 GLY QA 1 13 ALA H 5.000 . 5.000 2.433 2.157 2.844 . 0 0 "[ . 1 . 2]" 1
627 1 15 GLY H 1 16 LYS H 5.000 . 5.000 2.808 1.887 3.831 . 0 0 "[ . 1 . 2]" 1
628 1 13 ALA HA 1 16 LYS H 5.000 . 5.000 4.456 2.789 5.329 0.329 16 0 "[ . 1 . 2]" 1
629 1 17 THR H 1 17 THR HB 3.500 . 3.500 2.925 2.222 3.665 0.165 3 0 "[ . 1 . 2]" 1
630 1 17 THR H 1 18 CYS H 5.000 . 5.000 2.882 2.170 3.469 . 0 0 "[ . 1 . 2]" 1
631 1 17 THR HB 1 18 CYS H 5.000 . 5.000 3.321 2.046 3.953 . 0 0 "[ . 1 . 2]" 1
632 1 17 THR MG 1 18 CYS H 5.000 . 5.000 2.810 1.798 4.296 . 0 0 "[ . 1 . 2]" 1
633 1 18 CYS H 1 19 LEU H 5.000 . 5.000 2.765 2.508 3.045 . 0 0 "[ . 1 . 2]" 1
634 1 19 LEU H 1 19 LEU QD 5.000 . 5.000 3.403 2.961 3.717 . 0 0 "[ . 1 . 2]" 1
635 1 19 LEU H 1 19 LEU HG 5.000 . 5.000 4.176 2.607 4.619 . 0 0 "[ . 1 . 2]" 1
636 1 19 LEU H 1 20 LEU H 5.000 . 5.000 3.171 3.007 3.381 . 0 0 "[ . 1 . 2]" 1
637 1 19 LEU QD 1 20 LEU H 5.000 . 5.000 3.321 2.337 3.720 . 0 0 "[ . 1 . 2]" 1
638 1 20 LEU H 1 20 LEU QD 3.500 . 3.500 2.541 1.844 3.097 . 0 0 "[ . 1 . 2]" 1
639 1 20 LEU H 1 21 ILE H 5.000 . 5.000 2.871 2.575 3.135 . 0 0 "[ . 1 . 2]" 1
640 1 20 LEU HG 1 21 ILE H 5.000 . 5.000 4.493 3.837 5.043 0.043 7 0 "[ . 1 . 2]" 1
641 1 21 ILE H 1 21 ILE QG 5.000 . 5.000 3.104 1.937 3.668 . 0 0 "[ . 1 . 2]" 1
642 1 21 ILE H 1 22 SER H 5.000 . 5.000 2.997 2.607 3.189 . 0 0 "[ . 1 . 2]" 1
643 1 21 ILE HB 1 22 SER H 5.000 . 5.000 2.507 1.954 2.925 . 0 0 "[ . 1 . 2]" 1
644 1 21 ILE QG 1 22 SER H 5.000 . 5.000 4.188 3.572 4.572 . 0 0 "[ . 1 . 2]" 1
645 1 22 SER H 1 22 SER QB 3.500 . 3.500 2.356 2.150 2.738 . 0 0 "[ . 1 . 2]" 1
646 1 22 SER H 1 23 TYR H 5.000 . 5.000 2.389 2.229 2.573 . 0 0 "[ . 1 . 2]" 1
647 1 23 TYR H 1 23 TYR QD 5.000 . 5.000 3.705 2.483 4.207 . 0 0 "[ . 1 . 2]" 1
648 1 24 THR HA 1 25 THR H 5.000 . 5.000 3.493 3.036 3.554 . 0 0 "[ . 1 . 2]" 1
649 1 25 THR HA 1 26 ASN H 5.000 . 5.000 3.466 3.234 3.553 . 0 0 "[ . 1 . 2]" 1
650 1 25 THR MG 1 26 ASN H 5.000 . 5.000 2.597 1.923 4.137 . 0 0 "[ . 1 . 2]" 1
651 1 26 ASN H 1 27 LYS H . . 3.500 2.771 2.515 3.528 0.028 1 0 "[ . 1 . 2]" 1
652 1 25 THR HB 1 27 LYS H 5.000 . 5.000 4.586 3.274 5.092 0.092 15 0 "[ . 1 . 2]" 1
653 1 25 THR MG 1 27 LYS H 5.000 . 5.000 2.283 1.771 4.467 . 0 0 "[ . 1 . 2]" 1
654 1 27 LYS QB 1 28 PHE H 3.500 . 3.500 2.627 1.883 3.659 0.159 20 0 "[ . 1 . 2]" 1
655 1 27 LYS QG 1 28 PHE H 5.000 . 5.000 2.597 1.914 4.363 . 0 0 "[ . 1 . 2]" 1
656 1 28 PHE H 1 28 PHE QB 3.500 . 3.500 2.357 2.049 3.215 . 0 0 "[ . 1 . 2]" 1
657 1 28 PHE H 1 28 PHE QD 5.000 . 5.000 3.468 2.493 4.161 . 0 0 "[ . 1 . 2]" 1
658 1 29 PRO QB 1 30 SER H . . 3.500 2.989 2.489 3.378 . 0 0 "[ . 1 . 2]" 1
659 1 30 SER H 1 31 GLU H 3.500 . 3.500 2.828 2.609 3.304 . 0 0 "[ . 1 . 2]" 1
660 1 30 SER HA 1 31 GLU H 5.000 . 5.000 3.545 3.525 3.567 . 0 0 "[ . 1 . 2]" 1
661 1 30 SER QB 1 31 GLU H 5.000 . 5.000 2.135 1.906 2.598 . 0 0 "[ . 1 . 2]" 1
662 1 31 GLU H 1 32 TYR H 5.000 . 5.000 4.337 4.180 4.533 . 0 0 "[ . 1 . 2]" 1
663 1 31 GLU HA 1 32 TYR H 3.500 . 3.500 2.177 2.143 2.306 . 0 0 "[ . 1 . 2]" 1
664 1 31 GLU QB 1 32 TYR H 5.000 . 5.000 3.483 2.638 3.862 . 0 0 "[ . 1 . 2]" 1
665 1 31 GLU QG 1 32 TYR H 5.000 . 5.000 4.100 3.707 4.464 . 0 0 "[ . 1 . 2]" 1
666 1 32 TYR H 1 32 TYR QB 3.500 . 3.500 2.280 2.249 2.337 . 0 0 "[ . 1 . 2]" 1
667 1 32 TYR H 1 32 TYR QD 5.000 . 5.000 4.210 4.201 4.240 . 0 0 "[ . 1 . 2]" 1
668 1 32 TYR H 1 33 VAL H 5.000 . 5.000 4.315 4.172 4.392 . 0 0 "[ . 1 . 2]" 1
669 1 32 TYR HA 1 33 VAL H 3.500 . 3.500 2.140 2.111 2.216 . 0 0 "[ . 1 . 2]" 1
670 1 32 TYR QB 1 33 VAL H 5.000 . 5.000 3.918 3.857 4.003 . 0 0 "[ . 1 . 2]" 1
671 1 34 PRO HA 1 35 THR H 5.000 . 5.000 2.286 2.190 2.335 . 0 0 "[ . 1 . 2]" 1
672 1 35 THR HA 1 36 VAL H 5.000 . 5.000 2.258 2.232 2.275 . 0 0 "[ . 1 . 2]" 1
673 1 35 THR MG 1 36 VAL H 5.000 . 5.000 3.481 3.394 4.046 . 0 0 "[ . 1 . 2]" 1
674 1 36 VAL H 1 37 PHE H 5.000 . 5.000 2.323 2.129 2.666 . 0 0 "[ . 1 . 2]" 1
675 1 36 VAL HB 1 37 PHE H 5.000 . 5.000 2.898 2.339 4.063 . 0 0 "[ . 1 . 2]" 1
676 1 37 PHE HA 1 38 ASP H 3.500 . 3.500 3.142 2.097 3.560 0.060 14 0 "[ . 1 . 2]" 1
677 1 37 PHE QB 1 38 ASP H 5.000 . 5.000 2.666 1.982 4.065 . 0 0 "[ . 1 . 2]" 1
678 1 37 PHE QD 1 38 ASP H 5.000 . 5.000 3.310 2.397 4.084 . 0 0 "[ . 1 . 2]" 1
679 1 38 ASP HA 1 39 ASN H 3.500 . 3.500 2.171 2.135 2.303 . 0 0 "[ . 1 . 2]" 1
680 1 39 ASN H 2 13 ILE HB 5.000 . 5.000 3.670 3.374 4.013 . 0 0 "[ . 1 . 2]" 1
681 1 39 ASN H 2 13 ILE H 5.000 . 5.000 2.765 2.388 3.155 . 0 0 "[ . 1 . 2]" 1
682 1 39 ASN HA 1 40 TYR H 5.000 . 5.000 2.307 2.223 2.439 . 0 0 "[ . 1 . 2]" 1
683 1 40 TYR H 1 40 TYR QD 5.000 . 5.000 2.564 2.187 3.239 . 0 0 "[ . 1 . 2]" 1
684 1 40 TYR HA 1 41 ALA H 5.000 . 5.000 2.388 2.215 2.463 . 0 0 "[ . 1 . 2]" 1
685 1 40 TYR QD 1 41 ALA H 5.000 . 5.000 4.435 4.146 4.774 . 0 0 "[ . 1 . 2]" 1
686 1 41 ALA H 2 9 PHE QB 5.000 . 5.000 3.880 1.914 4.843 . 0 0 "[ . 1 . 2]" 1
687 1 41 ALA H 2 10 GLU H 5.000 . 5.000 1.993 1.882 2.180 . 0 0 "[ . 1 . 2]" 1
688 1 42 VAL H 1 53 LEU QD 5.000 . 5.000 4.900 4.503 5.056 0.056 18 0 "[ . 1 . 2]" 1
689 1 42 VAL HA 1 43 THR H 5.000 . 5.000 2.248 2.130 2.433 . 0 0 "[ . 1 . 2]" 1
690 1 42 VAL QG 1 43 THR H 5.000 . 5.000 3.311 3.109 3.494 . 0 0 "[ . 1 . 2]" 1
691 1 43 THR H 2 6 PRO HA 5.000 . 5.000 2.717 2.430 3.251 . 0 0 "[ . 1 . 2]" 1
692 1 43 THR HA 1 44 VAL H 3.500 . 3.500 2.180 2.143 2.275 . 0 0 "[ . 1 . 2]" 1
693 1 43 THR MG 1 44 VAL H 5.000 . 5.000 3.169 2.851 3.666 . 0 0 "[ . 1 . 2]" 1
694 1 44 VAL H 1 52 THR HA 5.000 . 5.000 4.758 3.651 5.034 0.034 7 0 "[ . 1 . 2]" 1
695 1 44 VAL HA 1 45 MET H 5.000 . 5.000 2.192 2.112 2.566 . 0 0 "[ . 1 . 2]" 1
696 1 44 VAL QG 1 45 MET H 5.000 . 5.000 3.047 2.283 3.575 . 0 0 "[ . 1 . 2]" 1
697 1 45 MET HA 1 46 ILE H 5.000 . 5.000 2.189 2.131 2.332 . 0 0 "[ . 1 . 2]" 1
698 1 46 ILE H 1 49 GLU H 5.000 . 5.000 3.413 2.256 4.793 . 0 0 "[ . 1 . 2]" 1
699 1 46 ILE H 1 50 PRO HA 5.000 . 5.000 4.768 4.102 5.059 0.059 12 0 "[ . 1 . 2]" 1
700 1 46 ILE HA 1 47 GLY H 3.500 . 3.500 2.207 2.143 2.260 . 0 0 "[ . 1 . 2]" 1
701 1 47 GLY H 1 48 GLY H 5.000 . 5.000 2.456 2.284 2.693 . 0 0 "[ . 1 . 2]" 1
702 1 47 GLY QA 1 48 GLY H 5.000 . 5.000 2.888 2.837 2.937 . 0 0 "[ . 1 . 2]" 1
703 1 48 GLY H 1 49 GLU H 5.000 . 5.000 2.469 2.055 3.137 . 0 0 "[ . 1 . 2]" 1
704 1 48 GLY H 2 3 ILE HA 5.000 . 5.000 5.036 4.955 5.073 0.073 6 0 "[ . 1 . 2]" 1
705 1 48 GLY QA 1 49 GLU H 5.000 . 5.000 2.781 2.661 2.936 . 0 0 "[ . 1 . 2]" 1
706 1 44 VAL QG 1 51 TYR H 5.000 . 5.000 4.655 3.981 5.039 0.039 15 0 "[ . 1 . 2]" 1
707 1 44 VAL H 1 51 TYR H 5.000 . 5.000 3.913 3.141 4.765 . 0 0 "[ . 1 . 2]" 1
708 1 45 MET HA 1 51 TYR H 5.000 . 5.000 4.237 3.352 5.017 0.017 14 0 "[ . 1 . 2]" 1
709 1 50 PRO HA 1 51 TYR H 3.500 . 3.500 2.349 2.149 2.476 . 0 0 "[ . 1 . 2]" 1
710 1 51 TYR H 1 51 TYR QD 5.000 . 5.000 4.122 3.461 4.518 . 0 0 "[ . 1 . 2]" 1
711 1 3 THR HA 1 52 THR H 5.000 . 5.000 4.880 4.163 5.038 0.038 9 0 "[ . 1 . 2]" 1
712 1 51 TYR HA 1 52 THR H 3.500 . 3.500 2.385 2.189 2.536 . 0 0 "[ . 1 . 2]" 1
713 1 51 TYR QB 1 52 THR H 5.000 . 5.000 2.738 2.187 3.434 . 0 0 "[ . 1 . 2]" 1
714 1 43 THR HA 1 53 LEU H 5.000 . 5.000 3.575 2.855 4.674 . 0 0 "[ . 1 . 2]" 1
715 1 52 THR HA 1 53 LEU H 3.500 . 3.500 2.197 2.148 2.211 . 0 0 "[ . 1 . 2]" 1
716 1 53 LEU H 1 53 LEU QB . . 3.500 2.477 2.219 2.940 . 0 0 "[ . 1 . 2]" 1
717 1 4 ILE HB 1 54 GLY H 5.000 . 5.000 4.972 4.690 5.060 0.060 5 0 "[ . 1 . 2]" 1
718 1 53 LEU HA 1 54 GLY H 5.000 . 5.000 2.316 2.163 2.380 . 0 0 "[ . 1 . 2]" 1
719 1 53 LEU QB 1 54 GLY H 5.000 . 5.000 3.323 2.533 3.738 . 0 0 "[ . 1 . 2]" 1
720 1 53 LEU QD 1 54 GLY H 5.000 . 5.000 2.275 1.795 3.053 . 0 0 "[ . 1 . 2]" 1
721 1 54 GLY QA 1 55 LEU H 5.000 . 5.000 2.140 2.112 2.190 . 0 0 "[ . 1 . 2]" 1
722 1 55 LEU HA 1 56 PHE H 5.000 . 5.000 2.171 2.126 2.317 . 0 0 "[ . 1 . 2]" 1
723 1 55 LEU QD 1 56 PHE H 5.000 . 5.000 3.762 2.704 4.598 . 0 0 "[ . 1 . 2]" 1
724 1 56 PHE H 1 56 PHE QD 5.000 . 5.000 2.970 1.935 4.272 . 0 0 "[ . 1 . 2]" 1
725 1 56 PHE QB 1 57 ASP H 5.000 . 5.000 3.540 2.853 3.744 . 0 0 "[ . 1 . 2]" 1
726 1 57 ASP HA 1 58 THR H 3.500 . 3.500 2.433 2.143 2.797 . 0 0 "[ . 1 . 2]" 1
727 1 57 ASP QB 1 58 THR H 5.000 . 5.000 2.837 2.009 3.668 . 0 0 "[ . 1 . 2]" 1
728 1 58 THR HA 1 59 ALA H 5.000 . 5.000 2.395 2.152 2.703 . 0 0 "[ . 1 . 2]" 1
729 1 61 LEU H 1 61 LEU HG 5.000 . 5.000 3.677 2.037 4.605 . 0 0 "[ . 1 . 2]" 1
730 1 61 LEU QB 1 62 GLU H 5.000 . 5.000 2.593 1.934 4.002 . 0 0 "[ . 1 . 2]" 1
731 1 62 GLU H 1 63 ASP H 5.000 . 5.000 2.760 1.925 4.085 . 0 0 "[ . 1 . 2]" 1
732 1 61 LEU QB 1 63 ASP H 5.000 . 5.000 3.337 2.245 5.133 0.133 1 0 "[ . 1 . 2]" 1
733 1 62 GLU HA 1 63 ASP H 5.000 . 5.000 3.000 2.209 3.522 . 0 0 "[ . 1 . 2]" 1
734 1 63 ASP H 1 64 TYR H 5.000 . 5.000 2.502 1.932 3.453 . 0 0 "[ . 1 . 2]" 1
735 1 63 ASP HA 1 64 TYR H 5.000 . 5.000 3.100 2.633 3.455 . 0 0 "[ . 1 . 2]" 1
736 1 63 ASP QB 1 64 TYR H 5.000 . 5.000 3.622 2.939 4.033 . 0 0 "[ . 1 . 2]" 1
737 1 64 TYR H 1 65 ASP H . . 3.500 2.412 1.966 2.809 . 0 0 "[ . 1 . 2]" 1
738 1 62 GLU HA 1 65 ASP H 5.000 . 5.000 4.713 3.815 5.152 0.152 1 0 "[ . 1 . 2]" 1
739 1 64 TYR HA 1 65 ASP H 5.000 . 5.000 3.343 2.697 3.512 . 0 0 "[ . 1 . 2]" 1
740 1 65 ASP H 1 65 ASP QB 3.500 . 3.500 2.382 2.089 3.476 . 0 0 "[ . 1 . 2]" 1
741 1 65 ASP H 1 66 ARG H 5.000 . 5.000 3.039 2.772 4.644 . 0 0 "[ . 1 . 2]" 1
742 1 65 ASP QB 1 66 ARG H 5.000 . 5.000 2.863 1.909 3.587 . 0 0 "[ . 1 . 2]" 1
743 1 66 ARG H 1 67 LEU H 3.500 . 3.500 2.547 2.191 3.134 . 0 0 "[ . 1 . 2]" 1
744 1 66 ARG QB 1 67 LEU H 5.000 . 5.000 2.838 2.125 3.518 . 0 0 "[ . 1 . 2]" 1
745 1 67 LEU H 1 67 LEU QD 5.000 . 5.000 2.898 1.835 3.687 . 0 0 "[ . 1 . 2]" 1
746 1 67 LEU H 1 68 ARG H 5.000 . 5.000 3.110 2.526 4.610 . 0 0 "[ . 1 . 2]" 1
747 1 67 LEU HA 1 68 ARG H 5.000 . 5.000 2.884 2.352 3.284 . 0 0 "[ . 1 . 2]" 1
748 1 67 LEU QB 1 68 ARG H 5.000 . 5.000 3.571 2.012 3.900 . 0 0 "[ . 1 . 2]" 1
749 1 68 ARG H 1 68 ARG QD 5.000 . 5.000 3.877 2.322 4.466 . 0 0 "[ . 1 . 2]" 1
750 1 68 ARG H 1 69 PRO QD 5.000 . 5.000 1.971 1.817 2.358 . 0 0 "[ . 1 . 2]" 1
751 1 70 LEU H 1 71 SER H 5.000 . 5.000 2.706 2.103 4.356 . 0 0 "[ . 1 . 2]" 1
752 1 70 LEU QD 1 71 SER H 5.000 . 5.000 3.594 1.889 4.324 . 0 0 "[ . 1 . 2]" 1
753 1 70 LEU HG 1 71 SER H 5.000 . 5.000 4.045 2.905 5.220 0.220 18 0 "[ . 1 . 2]" 1
754 1 71 SER H 1 72 TYR H 5.000 . 5.000 2.184 1.902 2.785 . 0 0 "[ . 1 . 2]" 1
755 1 72 TYR H 1 72 TYR QD 5.000 . 5.000 3.054 2.355 4.201 . 0 0 "[ . 1 . 2]" 1
756 1 74 GLN H 1 75 THR H 5.000 . 5.000 2.640 2.367 2.745 . 0 0 "[ . 1 . 2]" 1
757 1 74 GLN HA 1 74 GLN QE 5.000 . 5.000 3.909 2.381 4.690 . 0 0 "[ . 1 . 2]" 1
758 1 74 GLN HA 1 75 THR H 5.000 . 5.000 3.373 3.349 3.427 . 0 0 "[ . 1 . 2]" 1
759 1 75 THR H 1 75 THR HB 3.500 . 3.500 2.439 2.296 2.646 . 0 0 "[ . 1 . 2]" 1
760 1 75 THR HA 1 76 ASP H 5.000 . 5.000 3.550 3.462 3.589 . 0 0 "[ . 1 . 2]" 1
761 1 75 THR MG 1 76 ASP H 5.000 . 5.000 1.987 1.801 2.452 . 0 0 "[ . 1 . 2]" 1
762 1 76 ASP H 1 77 VAL H 5.000 . 5.000 4.257 3.011 4.682 . 0 0 "[ . 1 . 2]" 1
763 1 6 CYS HA 1 77 VAL H 5.000 . 5.000 4.581 3.425 5.049 0.049 14 0 "[ . 1 . 2]" 1
764 1 76 ASP QB 1 77 VAL H 5.000 . 5.000 1.990 1.872 2.174 . 0 0 "[ . 1 . 2]" 1
765 1 77 VAL H 1 176 ALA MB 5.000 . 5.000 3.846 2.894 4.692 . 0 0 "[ . 1 . 2]" 1
766 1 77 VAL HA 1 78 PHE H 5.000 . 5.000 2.352 2.156 2.418 . 0 0 "[ . 1 . 2]" 1
767 1 77 VAL QG 1 78 PHE H 5.000 . 5.000 1.956 1.832 2.447 . 0 0 "[ . 1 . 2]" 1
768 1 78 PHE H 1 78 PHE QD 5.000 . 5.000 3.275 2.105 4.011 . 0 0 "[ . 1 . 2]" 1
769 1 78 PHE H 1 110 PHE HA 5.000 . 5.000 2.539 1.964 3.251 . 0 0 "[ . 1 . 2]" 1
770 1 78 PHE QD 1 79 LEU H 5.000 . 5.000 3.376 2.545 4.622 . 0 0 "[ . 1 . 2]" 1
771 1 79 LEU H 1 79 LEU HG 5.000 . 5.000 4.238 2.035 4.795 . 0 0 "[ . 1 . 2]" 1
772 1 79 LEU HA 1 80 VAL H 5.000 . 5.000 2.189 2.115 2.381 . 0 0 "[ . 1 . 2]" 1
773 1 10 GLY QA 1 81 CYS H 5.000 . 5.000 3.932 2.427 5.094 0.094 1 0 "[ . 1 . 2]" 1
774 1 80 VAL HA 1 81 CYS H 5.000 . 5.000 2.262 2.175 2.314 . 0 0 "[ . 1 . 2]" 1
775 1 81 CYS QB 1 82 PHE H 5.000 . 5.000 2.888 2.231 3.646 . 0 0 "[ . 1 . 2]" 1
776 1 82 PHE H 1 82 PHE QD 5.000 . 5.000 3.383 2.380 4.562 . 0 0 "[ . 1 . 2]" 1
777 1 82 PHE H 1 113 VAL QG 5.000 . 5.000 4.188 3.305 5.056 0.056 6 0 "[ . 1 . 2]" 1
778 1 82 PHE HA 1 83 SER H 5.000 . 5.000 2.267 2.137 2.646 . 0 0 "[ . 1 . 2]" 1
779 1 83 SER HA 1 84 VAL H 5.000 . 5.000 2.332 2.113 2.719 . 0 0 "[ . 1 . 2]" 1
780 1 83 SER HA 1 85 VAL H 5.000 . 5.000 4.714 3.909 5.130 0.130 7 0 "[ . 1 . 2]" 1
781 1 84 VAL H 1 85 VAL H 5.000 . 5.000 3.057 1.941 4.096 . 0 0 "[ . 1 . 2]" 1
782 1 85 VAL H 1 86 SER H 5.000 . 5.000 3.125 2.270 3.578 . 0 0 "[ . 1 . 2]" 1
783 1 85 VAL HA 1 86 SER H 5.000 . 5.000 3.363 2.340 3.568 . 0 0 "[ . 1 . 2]" 1
784 1 85 VAL QG 1 86 SER H 5.000 . 5.000 2.287 1.703 3.744 . 0 0 "[ . 1 . 2]" 1
785 1 87 PRO QB 1 88 SER H 5.000 . 5.000 3.098 2.527 3.455 . 0 0 "[ . 1 . 2]" 1
786 1 88 SER H 1 88 SER QB 3.500 . 3.500 2.388 2.073 2.906 . 0 0 "[ . 1 . 2]" 1
787 1 88 SER H 1 89 SER H 5.000 . 5.000 2.772 2.325 3.271 . 0 0 "[ . 1 . 2]" 1
788 1 87 PRO HA 1 90 PHE H 5.000 . 5.000 3.216 2.788 4.423 . 0 0 "[ . 1 . 2]" 1
789 1 90 PHE H 1 90 PHE QD 5.000 . 5.000 3.418 2.318 4.010 . 0 0 "[ . 1 . 2]" 1
790 1 90 PHE H 1 91 GLU H 5.000 . 5.000 3.040 2.797 3.193 . 0 0 "[ . 1 . 2]" 1
791 1 90 PHE QB 1 91 GLU H 5.000 . 5.000 2.242 1.946 2.693 . 0 0 "[ . 1 . 2]" 1
792 1 90 PHE QD 1 91 GLU H 5.000 . 5.000 4.096 3.645 4.593 . 0 0 "[ . 1 . 2]" 1
793 1 89 SER HA 1 92 ASN H 5.000 . 5.000 3.523 3.255 3.723 . 0 0 "[ . 1 . 2]" 1
794 1 91 GLU QB 1 92 ASN H 3.500 . 3.500 2.632 2.217 3.236 . 0 0 "[ . 1 . 2]" 1
795 1 91 GLU QG 1 92 ASN H 5.000 . 5.000 4.039 1.887 4.555 . 0 0 "[ . 1 . 2]" 1
796 1 92 ASN H 1 92 ASN QD 5.000 . 5.000 3.520 2.251 4.609 . 0 0 "[ . 1 . 2]" 1
797 1 92 ASN H 1 93 VAL H 5.000 . 5.000 2.888 2.565 3.204 . 0 0 "[ . 1 . 2]" 1
798 1 90 PHE HA 1 93 VAL H 5.000 . 5.000 3.937 3.514 4.645 . 0 0 "[ . 1 . 2]" 1
799 1 93 VAL H 1 94 LYS H 5.000 . 5.000 2.958 2.837 3.164 . 0 0 "[ . 1 . 2]" 1
800 1 93 VAL HB 1 94 LYS H 5.000 . 5.000 2.948 2.051 4.052 . 0 0 "[ . 1 . 2]" 1
801 1 94 LYS H 1 94 LYS QG 5.000 . 5.000 3.614 2.835 4.086 . 0 0 "[ . 1 . 2]" 1
802 1 94 LYS H 1 95 GLU H 5.000 . 5.000 2.807 2.490 3.084 . 0 0 "[ . 1 . 2]" 1
803 1 94 LYS H 1 145 LEU QD 5.000 . 5.000 5.009 4.790 5.079 0.079 11 0 "[ . 1 . 2]" 1
804 1 94 LYS HA 1 95 GLU H 5.000 . 5.000 3.563 3.524 3.576 . 0 0 "[ . 1 . 2]" 1
805 1 94 LYS QG 1 95 GLU H 5.000 . 5.000 3.951 2.871 4.422 . 0 0 "[ . 1 . 2]" 1
806 1 95 GLU H 1 95 GLU QG 5.000 . 5.000 3.063 2.035 4.043 . 0 0 "[ . 1 . 2]" 1
807 1 95 GLU H 1 96 LYS H 5.000 . 5.000 2.722 2.613 2.813 . 0 0 "[ . 1 . 2]" 1
808 1 95 GLU QB 1 96 LYS H 5.000 . 5.000 3.600 3.196 3.959 . 0 0 "[ . 1 . 2]" 1
809 1 96 LYS H 1 96 LYS QG 5.000 . 5.000 3.882 2.712 4.201 . 0 0 "[ . 1 . 2]" 1
810 1 96 LYS QB 1 97 TRP H 5.000 . 5.000 2.608 2.480 2.913 . 0 0 "[ . 1 . 2]" 1
811 1 96 LYS H 1 97 TRP H 5.000 . 5.000 2.045 1.916 2.143 . 0 0 "[ . 1 . 2]" 1
812 1 11 ASP HA 1 97 TRP HE1 5.000 . 5.000 4.948 4.248 5.069 0.069 18 0 "[ . 1 . 2]" 1
813 1 97 TRP QB 1 98 VAL H 5.000 . 5.000 2.724 2.404 3.215 . 0 0 "[ . 1 . 2]" 1
814 1 98 VAL H 1 99 PRO QD 5.000 . 5.000 2.236 2.027 2.353 . 0 0 "[ . 1 . 2]" 1
815 1 97 TRP QB 1 100 GLU H 5.000 . 5.000 4.651 4.361 4.975 . 0 0 "[ . 1 . 2]" 1
816 1 100 GLU H 1 100 GLU QB 3.500 . 3.500 2.277 2.056 2.714 . 0 0 "[ . 1 . 2]" 1
817 1 100 GLU H 1 100 GLU QG 5.000 . 5.000 3.312 1.996 4.092 . 0 0 "[ . 1 . 2]" 1
818 1 100 GLU H 1 101 ILE H 5.000 . 5.000 2.383 2.215 2.747 . 0 0 "[ . 1 . 2]" 1
819 1 100 GLU QB 1 101 ILE H 5.000 . 5.000 2.895 2.322 3.740 . 0 0 "[ . 1 . 2]" 1
820 1 101 ILE HA 1 102 THR H 5.000 . 5.000 3.488 3.458 3.534 . 0 0 "[ . 1 . 2]" 1
821 1 101 ILE QG 1 102 THR H 5.000 . 5.000 3.774 1.933 4.587 . 0 0 "[ . 1 . 2]" 1
822 1 101 ILE H 1 102 THR H 5.000 . 5.000 2.810 2.754 2.872 . 0 0 "[ . 1 . 2]" 1
823 1 102 THR H 1 103 HIS H 5.000 . 5.000 2.474 2.269 2.832 . 0 0 "[ . 1 . 2]" 1
824 1 103 HIS H 1 104 HIS H 5.000 . 5.000 2.647 2.474 2.834 . 0 0 "[ . 1 . 2]" 1
825 1 103 HIS QB 1 104 HIS H 5.000 . 5.000 2.641 2.352 2.875 . 0 0 "[ . 1 . 2]" 1
826 1 104 HIS H 1 105 CYS H 5.000 . 5.000 2.375 1.942 2.920 . 0 0 "[ . 1 . 2]" 1
827 1 102 THR HA 1 105 CYS H 5.000 . 5.000 3.441 3.038 4.471 . 0 0 "[ . 1 . 2]" 1
828 1 103 HIS QB 1 105 CYS H 5.000 . 5.000 4.713 4.445 5.039 0.039 13 0 "[ . 1 . 2]" 1
829 1 104 HIS HA 1 105 CYS H 5.000 . 5.000 3.512 3.309 3.580 . 0 0 "[ . 1 . 2]" 1
830 1 105 CYS QB 1 107 LYS H 5.000 . 5.000 4.252 3.369 5.016 0.016 6 0 "[ . 1 . 2]" 1
831 1 106 PRO QB 1 107 LYS H 5.000 . 5.000 2.752 1.930 4.016 . 0 0 "[ . 1 . 2]" 1
832 1 107 LYS H 1 107 LYS QB 3.500 . 3.500 3.053 2.564 3.381 . 0 0 "[ . 1 . 2]" 1
833 1 107 LYS H 1 108 THR H 3.500 . 3.500 2.442 2.015 3.375 . 0 0 "[ . 1 . 2]" 1
834 1 78 PHE QD 1 108 THR H 5.000 . 5.000 5.004 4.790 5.082 0.082 18 0 "[ . 1 . 2]" 1
835 1 105 CYS QB 1 108 THR H 5.000 . 5.000 3.158 2.436 3.854 . 0 0 "[ . 1 . 2]" 1
836 1 107 LYS HA 1 108 THR H 3.500 . 3.500 2.845 2.299 3.562 0.062 14 0 "[ . 1 . 2]" 1
837 1 107 LYS QB 1 108 THR H 5.000 . 5.000 3.836 2.312 4.039 . 0 0 "[ . 1 . 2]" 1
838 1 108 THR H 1 108 THR HB 3.500 . 3.500 3.054 2.460 3.447 . 0 0 "[ . 1 . 2]" 1
839 1 109 PRO QB 1 110 PHE H 5.000 . 5.000 2.854 2.305 3.492 . 0 0 "[ . 1 . 2]" 1
840 1 109 PRO QG 1 110 PHE H 5.000 . 5.000 4.458 4.073 4.786 . 0 0 "[ . 1 . 2]" 1
841 1 110 PHE H 1 110 PHE QD 5.000 . 5.000 3.118 2.754 3.440 . 0 0 "[ . 1 . 2]" 1
842 1 110 PHE HA 1 111 LEU H 5.000 . 5.000 2.243 2.138 2.598 . 0 0 "[ . 1 . 2]" 1
843 1 111 LEU HA 1 112 LEU H 5.000 . 5.000 2.185 2.142 2.418 . 0 0 "[ . 1 . 2]" 1
844 1 112 LEU H 1 112 LEU QD 5.000 . 5.000 3.033 1.843 3.834 . 0 0 "[ . 1 . 2]" 1
845 1 80 VAL QG 1 113 VAL H 5.000 . 5.000 4.209 3.302 4.911 . 0 0 "[ . 1 . 2]" 1
846 1 81 CYS HA 1 113 VAL H 5.000 . 5.000 3.164 2.306 4.604 . 0 0 "[ . 1 . 2]" 1
847 1 112 LEU HA 1 113 VAL H 5.000 . 5.000 2.233 2.130 2.408 . 0 0 "[ . 1 . 2]" 1
848 1 113 VAL HA 1 114 GLY H 5.000 . 5.000 2.283 2.144 2.552 . 0 0 "[ . 1 . 2]" 1
849 1 113 VAL QG 1 114 GLY H 5.000 . 5.000 2.880 1.859 3.636 . 0 0 "[ . 1 . 2]" 1
850 1 83 SER HA 1 115 THR H 5.000 . 5.000 4.164 2.805 5.472 0.472 13 0 "[ . 1 . 2]" 1
851 1 84 VAL H 1 115 THR H 5.000 . 5.000 4.170 2.643 5.047 0.047 4 0 "[ . 1 . 2]" 1
852 1 114 GLY QA 1 115 THR H 5.000 . 5.000 2.190 2.103 2.295 . 0 0 "[ . 1 . 2]" 1
853 1 116 GLN HA 1 117 ILE H 5.000 . 5.000 2.412 2.157 2.869 . 0 0 "[ . 1 . 2]" 1
854 1 116 GLN H 1 117 ILE H 5.000 . 5.000 2.994 1.938 4.253 . 0 0 "[ . 1 . 2]" 1
855 1 117 ILE H 1 117 ILE QG 5.000 . 5.000 2.110 1.829 2.928 . 0 0 "[ . 1 . 2]" 1
856 1 117 ILE H 1 118 ASP H 5.000 . 5.000 2.438 2.119 2.989 . 0 0 "[ . 1 . 2]" 1
857 1 116 GLN HA 1 118 ASP H 5.000 . 5.000 3.651 3.080 4.651 . 0 0 "[ . 1 . 2]" 1
858 1 117 ILE HA 1 118 ASP H 5.000 . 5.000 3.506 3.440 3.572 . 0 0 "[ . 1 . 2]" 1
859 1 117 ILE QG 1 118 ASP H 5.000 . 5.000 3.517 2.401 4.157 . 0 0 "[ . 1 . 2]" 1
860 1 118 ASP H 1 119 LEU H 5.000 . 5.000 2.452 2.167 3.015 . 0 0 "[ . 1 . 2]" 1
861 1 119 LEU H 1 119 LEU HG 5.000 . 5.000 4.353 3.582 4.670 . 0 0 "[ . 1 . 2]" 1
862 1 119 LEU H 1 120 ARG H 5.000 . 5.000 2.627 2.208 2.922 . 0 0 "[ . 1 . 2]" 1
863 1 120 ARG H 1 120 ARG QG 5.000 . 5.000 2.932 1.891 4.038 . 0 0 "[ . 1 . 2]" 1
864 1 120 ARG H 1 121 ASP H 5.000 . 5.000 3.424 2.567 4.643 . 0 0 "[ . 1 . 2]" 1
865 1 120 ARG HA 1 121 ASP H 5.000 . 5.000 3.014 2.194 3.508 . 0 0 "[ . 1 . 2]" 1
866 1 120 ARG QB 1 121 ASP H 5.000 . 5.000 3.182 1.901 4.027 . 0 0 "[ . 1 . 2]" 1
867 1 119 LEU QD 1 122 ASP H 5.000 . 5.000 4.653 3.560 5.027 0.027 16 0 "[ . 1 . 2]" 1
868 1 121 ASP HA 1 122 ASP H 5.000 . 5.000 2.972 2.538 3.555 . 0 0 "[ . 1 . 2]" 1
869 1 121 ASP H 1 122 ASP H 3.500 . 3.500 2.801 1.960 3.498 . 0 0 "[ . 1 . 2]" 1
870 1 122 ASP H 1 122 ASP QB 3.500 . 3.500 2.266 2.047 2.627 . 0 0 "[ . 1 . 2]" 1
871 1 123 PRO QG 1 124 SER H 5.000 . 5.000 3.157 1.939 4.022 . 0 0 "[ . 1 . 2]" 1
872 1 124 SER H 1 125 THR H 5.000 . 5.000 2.646 2.231 2.908 . 0 0 "[ . 1 . 2]" 1
873 1 124 SER HA 1 125 THR H 5.000 . 5.000 3.512 3.449 3.554 . 0 0 "[ . 1 . 2]" 1
874 1 125 THR HA 1 126 ILE H 5.000 . 5.000 3.559 3.481 3.575 . 0 0 "[ . 1 . 2]" 1
875 1 125 THR H 1 126 ILE H 5.000 . 5.000 2.988 2.726 3.156 . 0 0 "[ . 1 . 2]" 1
876 1 126 ILE QG 1 127 GLU H 5.000 . 5.000 4.251 3.678 4.419 . 0 0 "[ . 1 . 2]" 1
877 1 126 ILE MG 1 127 GLU H 5.000 . 5.000 3.475 3.311 3.587 . 0 0 "[ . 1 . 2]" 1
878 1 127 GLU H 1 128 LYS H . . 3.500 2.982 2.717 3.135 . 0 0 "[ . 1 . 2]" 1
879 1 127 GLU HA 1 128 LYS H 5.000 . 5.000 3.560 3.487 3.576 . 0 0 "[ . 1 . 2]" 1
880 1 128 LYS H 1 129 LEU H 5.000 . 5.000 2.448 2.249 2.590 . 0 0 "[ . 1 . 2]" 1
881 1 128 LYS HA 1 129 LEU H 5.000 . 5.000 3.516 3.505 3.533 . 0 0 "[ . 1 . 2]" 1
882 1 128 LYS QB 1 129 LEU H 3.500 . 3.500 2.718 2.648 2.766 . 0 0 "[ . 1 . 2]" 1
883 1 128 LYS QG 1 129 LEU H 5.000 . 5.000 3.703 3.551 3.887 . 0 0 "[ . 1 . 2]" 1
884 1 129 LEU H 1 129 LEU QB . . 3.500 2.121 2.035 2.576 . 0 0 "[ . 1 . 2]" 1
885 1 129 LEU H 1 130 ALA H 5.000 . 5.000 2.749 2.733 2.764 . 0 0 "[ . 1 . 2]" 1
886 1 129 LEU HA 1 130 ALA H 5.000 . 5.000 3.461 3.453 3.488 . 0 0 "[ . 1 . 2]" 1
887 1 129 LEU QB 1 130 ALA H 3.500 . 3.500 2.926 2.783 2.973 . 0 0 "[ . 1 . 2]" 1
888 1 130 ALA H 1 131 LYS H 3.500 . 3.500 2.511 2.417 2.631 . 0 0 "[ . 1 . 2]" 1
889 1 128 LYS HA 1 131 LYS H 5.000 . 5.000 3.247 3.107 3.397 . 0 0 "[ . 1 . 2]" 1
890 1 131 LYS H 1 132 ASN H 3.500 . 3.500 2.326 2.225 2.512 . 0 0 "[ . 1 . 2]" 1
891 1 128 LYS HA 1 132 ASN H 5.000 . 5.000 4.896 4.459 5.036 0.036 13 0 "[ . 1 . 2]" 1
892 1 128 LYS QG 1 132 ASN H 5.000 . 5.000 3.857 3.287 4.157 . 0 0 "[ . 1 . 2]" 1
893 1 130 ALA HA 1 132 ASN H 5.000 . 5.000 4.185 3.921 4.671 . 0 0 "[ . 1 . 2]" 1
894 1 131 LYS HA 1 132 ASN H 5.000 . 5.000 3.466 3.414 3.553 . 0 0 "[ . 1 . 2]" 1
895 1 131 LYS QB 1 132 ASN H 3.500 . 3.500 2.907 2.407 3.104 . 0 0 "[ . 1 . 2]" 1
896 1 130 ALA HA 1 133 LYS H 5.000 . 5.000 4.014 3.422 4.587 . 0 0 "[ . 1 . 2]" 1
897 1 132 ASN H 1 133 LYS H 3.500 . 3.500 2.655 2.210 2.890 . 0 0 "[ . 1 . 2]" 1
898 1 129 LEU QB 1 134 GLN H 5.000 . 5.000 4.569 3.912 5.028 0.028 7 0 "[ . 1 . 2]" 1
899 1 129 LEU QD 1 134 GLN H 5.000 . 5.000 3.983 2.443 5.042 0.042 19 0 "[ . 1 . 2]" 1
900 1 132 ASN H 1 134 GLN H 5.000 . 5.000 3.874 3.090 5.023 0.023 14 0 "[ . 1 . 2]" 1
901 1 133 LYS HA 1 134 GLN H 3.500 . 3.500 2.938 2.165 3.545 0.045 8 0 "[ . 1 . 2]" 1
902 1 133 LYS QD 1 134 GLN H 5.000 . 5.000 4.487 3.664 4.970 . 0 0 "[ . 1 . 2]" 1
903 1 133 LYS QE 1 134 GLN H 5.000 . 5.000 4.722 4.183 5.085 0.085 13 0 "[ . 1 . 2]" 1
904 1 133 LYS QG 1 134 GLN H 5.000 . 5.000 4.233 1.896 4.856 . 0 0 "[ . 1 . 2]" 1
905 1 134 GLN H 1 134 GLN QB 3.500 . 3.500 2.896 2.227 3.394 . 0 0 "[ . 1 . 2]" 1
906 1 134 GLN H 1 134 GLN QG 5.000 . 5.000 3.673 2.517 4.262 . 0 0 "[ . 1 . 2]" 1
907 1 134 GLN QB 1 135 LYS H 3.500 . 3.500 2.514 1.934 3.510 0.010 5 0 "[ . 1 . 2]" 1
908 1 134 GLN QG 1 135 LYS H 5.000 . 5.000 3.058 1.949 4.542 . 0 0 "[ . 1 . 2]" 1
909 1 135 LYS H 1 135 LYS QB 3.500 . 3.500 2.862 2.100 3.346 . 0 0 "[ . 1 . 2]" 1
910 1 135 LYS H 1 135 LYS QG 5.000 . 5.000 3.638 2.488 4.457 . 0 0 "[ . 1 . 2]" 1
911 1 136 PRO HA 1 137 ILE H 5.000 . 5.000 2.392 2.149 3.575 . 0 0 "[ . 1 . 2]" 1
912 1 136 PRO QB 1 137 ILE H 5.000 . 5.000 3.114 2.203 3.797 . 0 0 "[ . 1 . 2]" 1
913 1 137 ILE H 1 137 ILE QG 5.000 . 5.000 2.163 1.908 3.008 . 0 0 "[ . 1 . 2]" 1
914 1 138 THR HB 1 140 GLU H 5.000 . 5.000 3.485 3.051 4.254 . 0 0 "[ . 1 . 2]" 1
915 1 139 PRO QD 1 140 GLU H 5.000 . 5.000 2.908 2.772 3.323 . 0 0 "[ . 1 . 2]" 1
916 1 140 GLU H 1 141 THR H 5.000 . 5.000 2.399 2.244 2.723 . 0 0 "[ . 1 . 2]" 1
917 1 137 ILE MG 1 141 THR H 5.000 . 5.000 4.039 3.730 5.030 0.030 13 0 "[ . 1 . 2]" 1
918 1 140 GLU QB 1 141 THR H 5.000 . 5.000 2.719 2.298 3.534 . 0 0 "[ . 1 . 2]" 1
919 1 140 GLU QG 1 141 THR H 5.000 . 5.000 3.938 1.936 4.584 . 0 0 "[ . 1 . 2]" 1
920 1 137 ILE MG 1 142 ALA H 5.000 . 5.000 3.218 2.710 3.931 . 0 0 "[ . 1 . 2]" 1
921 1 141 THR HB 1 142 ALA H 5.000 . 5.000 2.352 2.043 2.570 . 0 0 "[ . 1 . 2]" 1
922 1 141 THR MG 1 142 ALA H 5.000 . 5.000 3.407 3.189 3.640 . 0 0 "[ . 1 . 2]" 1
923 1 142 ALA H 1 143 GLU H . . 3.500 2.899 2.748 3.025 . 0 0 "[ . 1 . 2]" 1
924 1 143 GLU H 1 144 LYS H 5.000 . 5.000 2.705 2.467 2.852 . 0 0 "[ . 1 . 2]" 1
925 1 141 THR HA 1 144 LYS H 5.000 . 5.000 3.405 3.117 3.584 . 0 0 "[ . 1 . 2]" 1
926 1 144 LYS HA 1 145 LEU H 5.000 . 5.000 3.554 3.503 3.572 . 0 0 "[ . 1 . 2]" 1
927 1 144 LYS QB 1 145 LEU H 5.000 . 5.000 2.446 2.177 2.727 . 0 0 "[ . 1 . 2]" 1
928 1 145 LEU H 1 145 LEU QB 3.500 . 3.500 2.176 2.035 2.233 . 0 0 "[ . 1 . 2]" 1
929 1 145 LEU H 1 146 ALA H 5.000 . 5.000 2.706 2.500 2.839 . 0 0 "[ . 1 . 2]" 1
930 1 112 LEU QD 1 146 ALA H 5.000 . 5.000 4.163 3.337 4.956 . 0 0 "[ . 1 . 2]" 1
931 1 145 LEU QB 1 146 ALA H 5.000 . 5.000 2.597 2.283 2.849 . 0 0 "[ . 1 . 2]" 1
932 1 146 ALA H 1 147 ARG H 5.000 . 5.000 2.661 2.484 2.913 . 0 0 "[ . 1 . 2]" 1
933 1 144 LYS HA 1 147 ARG H 5.000 . 5.000 3.491 3.288 3.712 . 0 0 "[ . 1 . 2]" 1
934 1 146 ALA HA 1 147 ARG H 5.000 . 5.000 3.514 3.456 3.570 . 0 0 "[ . 1 . 2]" 1
935 1 147 ARG H 1 147 ARG QB 3.500 . 3.500 2.282 2.238 2.687 . 0 0 "[ . 1 . 2]" 1
936 1 147 ARG H 1 147 ARG QD 5.000 . 5.000 4.358 3.969 4.534 . 0 0 "[ . 1 . 2]" 1
937 1 145 LEU HA 1 148 ASP H 3.500 . 3.500 3.480 3.342 3.600 0.100 11 0 "[ . 1 . 2]" 1
938 1 145 LEU QD 1 148 ASP H 5.000 . 5.000 4.628 3.963 5.003 0.003 2 0 "[ . 1 . 2]" 1
939 1 147 ARG QD 1 148 ASP H 5.000 . 5.000 4.709 3.804 4.981 . 0 0 "[ . 1 . 2]" 1
940 1 147 ARG QG 1 148 ASP H 3.500 . 3.500 3.324 1.939 3.536 0.036 12 0 "[ . 1 . 2]" 1
941 1 147 ARG H 1 148 ASP H 5.000 . 5.000 2.632 2.363 2.819 . 0 0 "[ . 1 . 2]" 1
942 1 145 LEU HA 1 149 LEU H 5.000 . 5.000 4.581 3.944 5.060 0.060 11 0 "[ . 1 . 2]" 1
943 1 146 ALA HA 1 149 LEU H 5.000 . 5.000 3.680 3.178 4.329 . 0 0 "[ . 1 . 2]" 1
944 1 148 ASP QB 1 149 LEU H 5.000 . 5.000 2.682 2.049 3.046 . 0 0 "[ . 1 . 2]" 1
945 1 149 LEU H 1 149 LEU HG 3.500 . 3.500 2.112 1.936 3.625 0.125 12 0 "[ . 1 . 2]" 1
946 1 149 LEU H 1 150 LYS H 5.000 . 5.000 2.408 2.034 2.896 . 0 0 "[ . 1 . 2]" 1
947 1 147 ARG HA 1 150 LYS H 5.000 . 5.000 3.268 2.889 3.717 . 0 0 "[ . 1 . 2]" 1
948 1 149 LEU HA 1 150 LYS H 5.000 . 5.000 3.319 2.911 3.478 . 0 0 "[ . 1 . 2]" 1
949 1 150 LYS H 1 151 ALA H 5.000 . 5.000 3.722 2.797 4.112 . 0 0 "[ . 1 . 2]" 1
950 1 150 LYS QB 1 151 ALA H 5.000 . 5.000 3.162 1.915 4.004 . 0 0 "[ . 1 . 2]" 1
951 1 150 LYS QG 1 151 ALA H 5.000 . 5.000 3.453 2.215 4.441 . 0 0 "[ . 1 . 2]" 1
952 1 111 LEU HA 1 153 LYS H 5.000 . 5.000 4.330 3.552 4.717 . 0 0 "[ . 1 . 2]" 1
953 1 112 LEU H 1 153 LYS H 5.000 . 5.000 5.016 4.427 5.248 0.248 10 0 "[ . 1 . 2]" 1
954 1 151 ALA MB 1 153 LYS H 3.500 . 3.500 2.501 2.142 3.269 . 0 0 "[ . 1 . 2]" 1
955 1 152 VAL HA 1 153 LYS H 5.000 . 5.000 3.432 3.349 3.569 . 0 0 "[ . 1 . 2]" 1
956 1 152 VAL HB 1 153 LYS H 3.500 . 3.500 3.225 2.070 3.745 0.245 15 0 "[ . 1 . 2]" 1
957 1 152 VAL H 1 153 LYS H 5.000 . 5.000 2.746 2.575 3.126 . 0 0 "[ . 1 . 2]" 1
958 1 153 LYS H 1 153 LYS QB 3.500 . 3.500 3.116 2.891 3.367 . 0 0 "[ . 1 . 2]" 1
959 1 153 LYS H 1 153 LYS QD 5.000 . 5.000 4.907 4.351 5.022 0.022 8 0 "[ . 1 . 2]" 1
960 1 153 LYS H 1 153 LYS QG 5.000 . 5.000 3.903 2.923 4.230 . 0 0 "[ . 1 . 2]" 1
961 1 153 LYS QD 1 154 TYR H 5.000 . 5.000 2.950 1.905 4.470 . 0 0 "[ . 1 . 2]" 1
962 1 153 LYS QG 1 154 TYR H 5.000 . 5.000 3.761 2.694 4.147 . 0 0 "[ . 1 . 2]" 1
963 1 153 LYS H 1 154 TYR H 5.000 . 5.000 4.107 3.862 4.358 . 0 0 "[ . 1 . 2]" 1
964 1 154 TYR H 1 154 TYR QB 3.500 . 3.500 3.208 2.702 3.318 . 0 0 "[ . 1 . 2]" 1
965 1 154 TYR HA 1 155 VAL H 3.500 . 3.500 2.267 2.145 2.424 . 0 0 "[ . 1 . 2]" 1
966 1 154 TYR QB 1 155 VAL H 5.000 . 5.000 2.809 2.343 3.730 . 0 0 "[ . 1 . 2]" 1
967 1 154 TYR QD 1 155 VAL H 5.000 . 5.000 3.898 2.349 4.968 . 0 0 "[ . 1 . 2]" 1
968 1 155 VAL HA 1 156 GLU H 3.500 . 3.500 2.154 2.140 2.173 . 0 0 "[ . 1 . 2]" 1
969 1 155 VAL H 1 156 GLU H 5.000 . 5.000 4.092 3.993 4.500 . 0 0 "[ . 1 . 2]" 1
970 1 156 GLU H 1 156 GLU QG 5.000 . 5.000 2.777 2.401 3.412 . 0 0 "[ . 1 . 2]" 1
971 1 117 ILE MD 1 157 CYS H 5.000 . 5.000 4.987 4.365 5.168 0.168 5 0 "[ . 1 . 2]" 1
972 1 157 CYS H 1 168 VAL QG 5.000 . 5.000 4.898 4.217 5.085 0.085 7 0 "[ . 1 . 2]" 1
973 1 117 ILE MD 1 158 SER H 5.000 . 5.000 2.117 1.808 2.926 . 0 0 "[ . 1 . 2]" 1
974 1 117 ILE MG 1 158 SER H 5.000 . 5.000 4.328 2.932 5.045 0.045 15 0 "[ . 1 . 2]" 1
975 1 157 CYS HA 1 158 SER H 5.000 . 5.000 2.654 2.144 2.762 . 0 0 "[ . 1 . 2]" 1
976 1 157 CYS QB 1 158 SER H 5.000 . 5.000 2.168 1.959 3.346 . 0 0 "[ . 1 . 2]" 1
977 1 158 SER HA 1 159 ALA H 5.000 . 5.000 2.374 2.170 2.502 . 0 0 "[ . 1 . 2]" 1
978 1 158 SER QB 1 159 ALA H 5.000 . 5.000 2.952 2.231 3.616 . 0 0 "[ . 1 . 2]" 1
979 1 159 ALA H 1 160 LEU H 5.000 . 5.000 4.233 2.890 4.617 . 0 0 "[ . 1 . 2]" 1
980 1 28 PHE QD 1 160 LEU H 5.000 . 5.000 5.040 4.413 5.165 0.165 14 0 "[ . 1 . 2]" 1
981 1 159 ALA MB 1 160 LEU H 5.000 . 5.000 2.022 1.854 3.573 . 0 0 "[ . 1 . 2]" 1
982 1 160 LEU H 1 160 LEU HG 5.000 . 5.000 3.789 2.428 4.547 . 0 0 "[ . 1 . 2]" 1
983 1 160 LEU H 1 161 THR H 5.000 . 5.000 3.397 2.600 4.657 . 0 0 "[ . 1 . 2]" 1
984 1 161 THR HA 1 162 GLN H 5.000 . 5.000 3.282 2.167 3.579 . 0 0 "[ . 1 . 2]" 1
985 1 161 THR MG 1 162 GLN H 5.000 . 5.000 3.662 3.076 3.887 . 0 0 "[ . 1 . 2]" 1
986 1 161 THR H 1 162 GLN H 5.000 . 5.000 3.360 2.573 4.603 . 0 0 "[ . 1 . 2]" 1
987 1 162 GLN H 1 163 LYS H 5.000 . 5.000 3.693 3.026 4.258 . 0 0 "[ . 1 . 2]" 1
988 1 162 GLN HA 1 163 LYS H 5.000 . 5.000 2.178 2.136 2.332 . 0 0 "[ . 1 . 2]" 1
989 1 163 LYS HA 1 164 GLY H 3.500 . 3.500 3.551 3.458 3.569 0.069 3 0 "[ . 1 . 2]" 1
990 1 163 LYS QB 1 164 GLY H 5.000 . 5.000 2.357 2.004 3.251 . 0 0 "[ . 1 . 2]" 1
991 1 163 LYS QD 1 164 GLY H 5.000 . 5.000 4.296 3.777 4.853 . 0 0 "[ . 1 . 2]" 1
992 1 163 LYS QG 1 164 GLY H 5.000 . 5.000 4.018 1.886 4.468 . 0 0 "[ . 1 . 2]" 1
993 1 164 GLY H 1 165 LEU H 5.000 . 5.000 3.335 2.771 3.687 . 0 0 "[ . 1 . 2]" 1
994 1 164 GLY QA 1 165 LEU H 5.000 . 5.000 2.298 2.172 2.548 . 0 0 "[ . 1 . 2]" 1
995 1 165 LEU H 1 165 LEU HG 5.000 . 5.000 2.734 1.940 4.635 . 0 0 "[ . 1 . 2]" 1
996 1 165 LEU H 1 166 LYS H 5.000 . 5.000 2.298 2.187 2.552 . 0 0 "[ . 1 . 2]" 1
997 1 165 LEU HA 1 166 LYS H 5.000 . 5.000 3.426 3.365 3.531 . 0 0 "[ . 1 . 2]" 1
998 1 165 LEU QD 1 166 LYS H 5.000 . 5.000 3.981 2.919 4.286 . 0 0 "[ . 1 . 2]" 1
999 1 166 LYS H 1 166 LYS QB 3.500 . 3.500 2.224 2.098 2.597 . 0 0 "[ . 1 . 2]" 1
1000 1 166 LYS H 1 166 LYS QD 3.500 . 3.500 3.555 3.395 3.658 0.158 9 0 "[ . 1 . 2]" 1
1001 1 166 LYS H 1 167 ASN H 5.000 . 5.000 2.790 2.600 2.990 . 0 0 "[ . 1 . 2]" 1
1002 1 166 LYS QB 1 167 ASN H 5.000 . 5.000 2.849 2.301 3.570 . 0 0 "[ . 1 . 2]" 1
1003 1 166 LYS QD 1 167 ASN H 5.000 . 5.000 3.450 1.925 5.003 0.003 17 0 "[ . 1 . 2]" 1
1004 1 167 ASN H 1 168 VAL H 5.000 . 5.000 2.923 2.554 3.199 . 0 0 "[ . 1 . 2]" 1
1005 1 155 VAL QG 1 167 ASN QD 5.000 . 5.000 3.396 2.046 4.779 . 0 0 "[ . 1 . 2]" 1
1006 1 166 LYS QB 1 167 ASN QD 5.000 . 5.000 4.440 3.627 4.959 . 0 0 "[ . 1 . 2]" 1
1007 1 155 VAL QG 1 168 VAL H 5.000 . 5.000 2.808 2.218 4.521 . 0 0 "[ . 1 . 2]" 1
1008 1 167 ASN QB 1 168 VAL H 5.000 . 5.000 2.275 1.919 2.854 . 0 0 "[ . 1 . 2]" 1
1009 1 168 VAL H 1 169 PHE H 5.000 . 5.000 2.870 2.764 3.112 . 0 0 "[ . 1 . 2]" 1
1010 1 168 VAL HB 1 169 PHE H 5.000 . 5.000 3.468 2.029 4.138 . 0 0 "[ . 1 . 2]" 1
1011 1 169 PHE H 1 170 ASP H 5.000 . 5.000 2.652 2.418 2.852 . 0 0 "[ . 1 . 2]" 1
1012 1 169 PHE QB 1 170 ASP H 5.000 . 5.000 2.715 2.411 3.001 . 0 0 "[ . 1 . 2]" 1
1013 1 170 ASP H 1 170 ASP QB . . 3.500 2.239 2.050 2.522 . 0 0 "[ . 1 . 2]" 1
1014 1 170 ASP H 1 171 GLU H 5.000 . 5.000 2.706 2.332 2.970 . 0 0 "[ . 1 . 2]" 1
1015 1 111 LEU QD 1 171 GLU H 5.000 . 5.000 4.934 4.171 5.151 0.151 13 0 "[ . 1 . 2]" 1
1016 1 167 ASN QB 1 171 GLU H 5.000 . 5.000 4.981 4.720 5.097 0.097 19 0 "[ . 1 . 2]" 1
1017 1 170 ASP HA 1 171 GLU H 5.000 . 5.000 3.528 3.480 3.567 . 0 0 "[ . 1 . 2]" 1
1018 1 171 GLU H 1 171 GLU QB 3.500 . 3.500 2.203 2.059 2.466 . 0 0 "[ . 1 . 2]" 1
1019 1 171 GLU H 1 171 GLU QG 5.000 . 5.000 3.379 2.365 4.067 . 0 0 "[ . 1 . 2]" 1
1020 1 111 LEU QD 1 172 ALA H 5.000 . 5.000 3.626 2.988 4.026 . 0 0 "[ . 1 . 2]" 1
1021 1 169 PHE HA 1 172 ALA H 5.000 . 5.000 3.365 3.048 3.854 . 0 0 "[ . 1 . 2]" 1
1022 1 171 GLU HA 1 172 ALA H 5.000 . 5.000 3.518 3.445 3.563 . 0 0 "[ . 1 . 2]" 1
1023 1 171 GLU QB 1 172 ALA H 5.000 . 5.000 2.694 2.309 3.052 . 0 0 "[ . 1 . 2]" 1
1024 1 171 GLU QG 1 172 ALA H 5.000 . 5.000 4.335 3.864 4.705 . 0 0 "[ . 1 . 2]" 1
1025 1 172 ALA H 1 173 ILE H 5.000 . 5.000 2.600 2.189 2.796 . 0 0 "[ . 1 . 2]" 1
1026 1 173 ILE H 1 173 ILE QG 5.000 . 5.000 2.385 2.038 3.310 . 0 0 "[ . 1 . 2]" 1
1027 1 171 GLU HA 1 174 LEU H 5.000 . 5.000 3.599 2.946 4.763 . 0 0 "[ . 1 . 2]" 1
1028 1 173 ILE HB 1 174 LEU H 5.000 . 5.000 2.579 2.055 3.035 . 0 0 "[ . 1 . 2]" 1
1029 1 173 ILE H 1 174 LEU H 5.000 . 5.000 2.413 2.192 2.818 . 0 0 "[ . 1 . 2]" 1
1030 1 174 LEU H 1 174 LEU QB 3.500 . 3.500 2.166 2.031 2.235 . 0 0 "[ . 1 . 2]" 1
1031 1 174 LEU H 1 175 ALA H 5.000 . 5.000 2.683 2.367 2.946 . 0 0 "[ . 1 . 2]" 1
1032 1 174 LEU HA 1 175 ALA H 5.000 . 5.000 3.512 3.442 3.571 . 0 0 "[ . 1 . 2]" 1
1033 1 174 LEU QB 1 175 ALA H 5.000 . 5.000 2.673 2.274 3.006 . 0 0 "[ . 1 . 2]" 1
1034 1 176 ALA H 1 177 LEU H 5.000 . 5.000 2.418 2.193 2.722 . 0 0 "[ . 1 . 2]" 1
1035 1 176 ALA MB 1 177 LEU H 5.000 . 5.000 2.910 2.379 3.126 . 0 0 "[ . 1 . 2]" 1
1036 1 177 LEU H 1 177 LEU HG 5.000 . 5.000 4.156 2.129 4.574 . 0 0 "[ . 1 . 2]" 1
1037 1 2 GLN QE 1 178 GLU H 5.000 . 5.000 4.697 4.246 5.003 0.003 18 0 "[ . 1 . 2]" 1
1038 1 175 ALA HA 1 178 GLU H 5.000 . 5.000 4.533 3.954 5.019 0.019 8 0 "[ . 1 . 2]" 1
1039 1 177 LEU HA 1 178 GLU H 5.000 . 5.000 3.212 2.484 3.571 . 0 0 "[ . 1 . 2]" 1
1040 1 177 LEU QB 1 178 GLU H 5.000 . 5.000 3.094 1.914 4.054 . 0 0 "[ . 1 . 2]" 1
1041 1 177 LEU QD 1 178 GLU H 5.000 . 5.000 3.996 2.984 4.559 . 0 0 "[ . 1 . 2]" 1
1042 1 177 LEU HG 1 178 GLU H 5.000 . 5.000 4.391 3.227 4.961 . 0 0 "[ . 1 . 2]" 1
1043 1 180 PRO QD 1 181 GLU H 5.000 . 5.000 4.961 4.758 5.006 0.006 17 0 "[ . 1 . 2]" 1
1044 1 181 GLU H 1 181 GLU QG 3.500 . 3.500 2.903 1.991 3.661 0.161 20 0 "[ . 1 . 2]" 1
1045 1 182 PRO QB 1 183 LYS H 5.000 . 5.000 3.314 1.969 3.991 . 0 0 "[ . 1 . 2]" 1
1046 1 183 LYS H 1 184 LYS H 5.000 . 5.000 4.426 4.057 4.646 . 0 0 "[ . 1 . 2]" 1
1047 2 2 SER HA 2 3 ILE H 3.500 . 3.500 3.539 3.472 3.568 0.068 15 0 "[ . 1 . 2]" 1
1048 2 2 SER QB 2 3 ILE H 5.000 . 5.000 2.446 1.906 3.355 . 0 0 "[ . 1 . 2]" 1
1049 2 3 ILE HA 2 4 SER H 5.000 . 5.000 2.254 2.169 2.296 . 0 0 "[ . 1 . 2]" 1
1050 2 3 ILE HB 2 4 SER H 5.000 . 5.000 3.984 3.899 4.361 . 0 0 "[ . 1 . 2]" 1
1051 2 3 ILE MD 2 4 SER H 5.000 . 5.000 3.754 3.389 5.000 . 9 0 "[ . 1 . 2]" 1
1052 2 4 SER HA 2 5 LEU H 3.500 . 3.500 2.253 2.161 2.542 . 0 0 "[ . 1 . 2]" 1
1053 1 42 VAL HB 2 7 SER H 5.000 . 5.000 4.795 4.121 5.032 0.032 12 0 "[ . 1 . 2]" 1
1054 1 44 VAL QG 2 7 SER H 5.000 . 5.000 5.056 4.944 5.161 0.161 20 0 "[ . 1 . 2]" 1
1055 2 6 PRO HA 2 7 SER H 5.000 . 5.000 2.521 2.196 3.567 . 0 0 "[ . 1 . 2]" 1
1056 2 6 PRO QB 2 7 SER H 5.000 . 5.000 2.590 1.943 3.086 . 0 0 "[ . 1 . 2]" 1
1057 1 43 THR H 2 8 ASP H 6.000 . 6.000 4.469 3.336 6.027 0.027 12 0 "[ . 1 . 2]" 1
1058 2 7 SER HA 2 8 ASP H 5.000 . 5.000 3.496 2.445 3.572 . 0 0 "[ . 1 . 2]" 1
1059 2 8 ASP H 2 9 PHE H 5.000 . 5.000 4.185 3.468 4.622 . 0 0 "[ . 1 . 2]" 1
1060 1 25 THR MG 2 9 PHE H 6.000 . 6.000 5.866 4.783 6.153 0.153 6 0 "[ . 1 . 2]" 1
1061 1 42 VAL QG 2 9 PHE H 5.000 . 5.000 4.907 4.003 5.053 0.053 16 0 "[ . 1 . 2]" 1
1062 2 9 PHE H 2 9 PHE QD 5.000 . 5.000 3.803 1.923 4.546 . 0 0 "[ . 1 . 2]" 1
1063 2 9 PHE H 2 10 GLU H 5.000 . 5.000 4.327 3.786 4.626 . 0 0 "[ . 1 . 2]" 1
1064 2 9 PHE HA 2 10 GLU H 5.000 . 5.000 2.252 2.143 2.688 . 0 0 "[ . 1 . 2]" 1
1065 2 9 PHE QB 2 10 GLU H 5.000 . 5.000 3.428 2.200 3.838 . 0 0 "[ . 1 . 2]" 1
1066 2 9 PHE QD 2 10 GLU H 5.000 . 5.000 3.417 2.574 3.741 . 0 0 "[ . 1 . 2]" 1
1067 1 40 TYR QD 2 11 HIS H 5.000 . 5.000 5.028 4.869 5.093 0.093 12 0 "[ . 1 . 2]" 1
1068 2 10 GLU QB 2 11 HIS H 5.000 . 5.000 3.229 2.929 3.869 . 0 0 "[ . 1 . 2]" 1
1069 2 10 GLU QG 2 11 HIS H . . 5.000 3.960 3.549 4.510 . 0 0 "[ . 1 . 2]" 1
1070 2 11 HIS H 2 11 HIS HD2 5.000 . 5.000 4.891 4.567 5.008 0.008 9 0 "[ . 1 . 2]" 1
1071 2 11 HIS H 2 12 THR MG 6.000 . 6.000 5.271 4.497 5.878 . 0 0 "[ . 1 . 2]" 1
1072 1 40 TYR HA 2 12 THR H 5.000 . 5.000 3.038 2.442 3.793 . 0 0 "[ . 1 . 2]" 1
1073 1 40 TYR QD 2 12 THR H 5.000 . 5.000 4.796 4.372 5.178 0.178 18 0 "[ . 1 . 2]" 1
1074 2 11 HIS HA 2 12 THR H 5.000 . 5.000 2.266 2.136 2.425 . 0 0 "[ . 1 . 2]" 1
1075 2 11 HIS QB 2 12 THR H 6.000 . 6.000 3.887 3.548 4.002 . 0 0 "[ . 1 . 2]" 1
1076 2 12 THR H 2 13 ILE H 5.000 . 5.000 3.155 2.569 3.534 . 0 0 "[ . 1 . 2]" 1
1077 1 38 ASP HA 2 13 ILE H 6.000 . 6.000 4.459 4.100 4.891 . 0 0 "[ . 1 . 2]" 1
1078 1 39 ASN QB 2 13 ILE H 5.000 . 5.000 2.058 1.810 2.902 . 0 0 "[ . 1 . 2]" 1
1079 1 40 TYR HA 2 13 ILE H 6.000 . 6.000 5.399 4.970 6.001 0.001 1 0 "[ . 1 . 2]" 1
1080 2 13 ILE H 2 14 HIS H 5.000 . 5.000 4.349 3.962 4.554 . 0 0 "[ . 1 . 2]" 1
1081 2 13 ILE HB 2 14 HIS H 6.000 . 6.000 3.932 3.443 4.223 . 0 0 "[ . 1 . 2]" 1
1082 2 13 ILE QG 2 14 HIS H 5.000 . 5.000 4.401 4.182 4.592 . 0 0 "[ . 1 . 2]" 1
1083 2 14 HIS H 2 14 HIS HD2 6.000 . 6.000 3.721 2.169 4.964 . 0 0 "[ . 1 . 2]" 1
1084 2 13 ILE MG 2 15 VAL H 6.000 . 6.000 3.820 3.390 4.238 . 0 0 "[ . 1 . 2]" 1
1085 2 15 VAL HA 2 16 GLY H 5.000 . 5.000 2.237 2.132 2.346 . 0 0 "[ . 1 . 2]" 1
1086 2 16 GLY H 2 24 PHE HA 6.000 . 6.000 4.236 3.863 4.489 . 0 0 "[ . 1 . 2]" 1
1087 2 16 GLY H 2 25 THR H 5.000 . 5.000 2.273 2.052 2.494 . 0 0 "[ . 1 . 2]" 1
1088 1 36 VAL QG 2 17 PHE H . . 5.000 3.644 3.109 4.432 . 0 0 "[ . 1 . 2]" 1
1089 2 16 GLY QA 2 17 PHE H 3.500 . 3.500 2.287 2.265 2.312 . 0 0 "[ . 1 . 2]" 1
1090 2 17 PHE H 2 18 ASP H 6.000 . 6.000 4.420 4.264 4.585 . 0 0 "[ . 1 . 2]" 1
1091 2 17 PHE H 2 25 THR MG 5.000 . 5.000 4.900 4.434 5.039 0.039 14 0 "[ . 1 . 2]" 1
1092 2 17 PHE HA 2 18 ASP H 3.500 . 3.500 2.148 2.123 2.193 . 0 0 "[ . 1 . 2]" 1
1093 2 18 ASP H 2 23 GLU H . . 5.000 4.342 3.988 4.772 . 0 0 "[ . 1 . 2]" 1
1094 2 17 PHE QD 2 19 ALA H 5.000 . 5.000 4.037 2.959 4.731 . 0 0 "[ . 1 . 2]" 1
1095 2 18 ASP HA 2 19 ALA H 2.800 . 2.800 2.158 2.134 2.199 . 0 0 "[ . 1 . 2]" 1
1096 2 18 ASP H 2 19 ALA H 6.000 . 6.000 4.201 4.013 4.395 . 0 0 "[ . 1 . 2]" 1
1097 2 19 ALA H 2 20 VAL H 5.000 . 5.000 2.604 2.486 2.673 . 0 0 "[ . 1 . 2]" 1
1098 2 20 VAL H 2 21 THR H 3.500 . 3.500 2.886 2.797 3.151 . 0 0 "[ . 1 . 2]" 1
1099 2 21 THR H 2 22 GLY H 5.000 . 5.000 2.062 1.857 2.763 . 0 0 "[ . 1 . 2]" 1
1100 2 21 THR H 2 23 GLU H 5.000 . 5.000 3.097 2.587 3.548 . 0 0 "[ . 1 . 2]" 1
1101 2 22 GLY H 2 23 GLU H 3.500 . 3.500 2.320 1.838 2.854 . 0 0 "[ . 1 . 2]" 1
1102 2 23 GLU H 2 24 PHE H 6.000 . 6.000 4.347 4.231 4.458 . 0 0 "[ . 1 . 2]" 1
1103 2 23 GLU HA 2 24 PHE H 3.500 . 3.500 2.694 2.419 2.871 . 0 0 "[ . 1 . 2]" 1
1104 2 24 PHE H 2 25 THR H . . 5.000 4.569 4.526 4.635 . 0 0 "[ . 1 . 2]" 1
1105 2 17 PHE HA 2 25 THR H 5.000 . 5.000 3.743 3.433 4.022 . 0 0 "[ . 1 . 2]" 1
1106 2 17 PHE QD 2 25 THR H 6.000 . 6.000 5.809 5.140 6.025 0.025 19 0 "[ . 1 . 2]" 1
1107 2 24 PHE QB 2 25 THR H 5.000 . 5.000 2.512 2.381 2.843 . 0 0 "[ . 1 . 2]" 1
1108 2 24 PHE QD 2 25 THR H 5.000 . 5.000 4.311 4.149 4.582 . 0 0 "[ . 1 . 2]" 1
1109 2 25 THR HA 2 26 GLY H 3.500 . 3.500 2.396 2.195 2.580 . 0 0 "[ . 1 . 2]" 1
1110 2 25 THR MG 2 26 GLY H 5.000 . 5.000 3.426 3.126 3.563 . 0 0 "[ . 1 . 2]" 1
1111 2 26 GLY H 2 27 MET H 5.000 . 5.000 2.834 2.579 2.990 . 0 0 "[ . 1 . 2]" 1
1112 2 27 MET H 2 27 MET ME 5.000 . 5.000 4.106 3.868 4.339 . 0 0 "[ . 1 . 2]" 1
1113 2 27 MET H 2 28 PRO QD 5.000 . 5.000 4.206 3.922 4.405 . 0 0 "[ . 1 . 2]" 1
1114 2 28 PRO QB 2 29 GLU H 5.000 . 5.000 2.976 2.743 3.207 . 0 0 "[ . 1 . 2]" 1
1115 2 28 PRO QG 2 29 GLU H 6.000 . 6.000 4.527 4.423 4.635 . 0 0 "[ . 1 . 2]" 1
1116 2 29 GLU HA 2 30 GLN H 5.000 . 5.000 3.554 3.441 3.579 . 0 0 "[ . 1 . 2]" 1
1117 2 29 GLU QB 2 30 GLN H 3.500 . 3.500 2.656 2.187 3.416 . 0 0 "[ . 1 . 2]" 1
1118 2 29 GLU QG 2 30 GLN H 6.000 . 6.000 3.545 1.845 4.414 . 0 0 "[ . 1 . 2]" 1
1119 2 30 GLN H 2 31 TRP H 5.000 . 5.000 2.744 2.553 3.072 . 0 0 "[ . 1 . 2]" 1
1120 2 30 GLN QG 2 31 TRP H 6.000 . 6.000 3.757 1.913 4.339 . 0 0 "[ . 1 . 2]" 1
1121 2 31 TRP H 2 32 ALA H 5.000 . 5.000 2.967 2.842 3.068 . 0 0 "[ . 1 . 2]" 1
1122 1 70 LEU QD 2 31 TRP HE1 5.000 . 5.000 3.191 1.889 3.985 . 0 0 "[ . 1 . 2]" 1
1123 2 27 MET ME 2 32 ALA H 6.000 . 6.000 3.684 3.059 3.894 . 0 0 "[ . 1 . 2]" 1
1124 2 27 MET QG 2 32 ALA H 5.000 . 5.000 4.435 2.822 5.089 0.089 17 0 "[ . 1 . 2]" 1
1125 2 31 TRP HA 2 32 ALA H 5.000 . 5.000 3.555 3.530 3.568 . 0 0 "[ . 1 . 2]" 1
1126 2 31 TRP QB 2 32 ALA H 5.000 . 5.000 2.371 2.217 2.531 . 0 0 "[ . 1 . 2]" 1
1127 2 32 ALA H 2 33 ARG H 5.000 . 5.000 3.032 2.776 3.217 . 0 0 "[ . 1 . 2]" 1
1128 2 33 ARG H 2 34 LEU H 5.000 . 5.000 2.833 2.651 2.928 . 0 0 "[ . 1 . 2]" 1
1129 2 31 TRP HA 2 34 LEU H 5.000 . 5.000 3.739 3.484 3.890 . 0 0 "[ . 1 . 2]" 1
1130 2 33 ARG QD 2 34 LEU H 6.000 . 6.000 4.483 4.136 5.035 . 0 0 "[ . 1 . 2]" 1
1131 2 34 LEU H 2 35 LEU H 5.000 . 5.000 2.994 2.877 3.138 . 0 0 "[ . 1 . 2]" 1
1132 2 31 TRP HA 2 35 LEU H 6.000 . 6.000 4.501 3.883 4.692 . 0 0 "[ . 1 . 2]" 1
1133 2 32 ALA HA 2 35 LEU H 5.000 . 5.000 3.853 3.602 4.158 . 0 0 "[ . 1 . 2]" 1
1134 2 35 LEU H 2 36 GLN H 5.000 . 5.000 2.638 2.471 2.695 . 0 0 "[ . 1 . 2]" 1
1135 2 36 GLN H 2 37 THR H 5.000 . 5.000 3.483 3.007 4.389 . 0 0 "[ . 1 . 2]" 1
1136 2 37 THR H 2 38 SER H . . 3.500 2.167 1.905 2.760 . 0 0 "[ . 1 . 2]" 1
1137 2 38 SER HA 2 39 ASN H 5.000 . 5.000 2.408 2.142 2.652 . 0 0 "[ . 1 . 2]" 1
1138 2 39 ASN H 2 40 ILE H 5.000 . 5.000 3.492 2.722 4.187 . 0 0 "[ . 1 . 2]" 1
1139 2 39 ASN HA 2 40 ILE H 5.000 . 5.000 2.899 2.248 3.555 . 0 0 "[ . 1 . 2]" 1
1140 2 42 LYS HA 2 43 SER H 5.000 . 5.000 2.991 2.412 3.571 . 0 0 "[ . 1 . 2]" 1
1141 2 43 SER HA 2 44 GLU H 5.000 . 5.000 2.719 2.141 3.571 . 0 0 "[ . 1 . 2]" 1
1142 2 45 GLN HA 2 46 LYS H 5.000 . 5.000 2.244 2.139 2.421 . 0 0 "[ . 1 . 2]" 1
1143 1 5 LYS H 1 72 TYR QE 5.000 . 5.000 4.922 3.955 5.103 0.103 14 0 "[ . 1 . 2]" 1
1144 1 103 HIS HA 1 103 HIS HD2 5.000 . 5.000 4.324 4.021 4.528 . 0 0 "[ . 1 . 2]" 1
1145 1 67 LEU QB 2 35 LEU QD 5.000 . 5.000 3.235 2.481 3.688 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 742
_Distance_constraint_stats_list.Viol_count 1898
_Distance_constraint_stats_list.Viol_total 86479.422
_Distance_constraint_stats_list.Viol_max 19.014
_Distance_constraint_stats_list.Viol_rms 1.4949
_Distance_constraint_stats_list.Viol_average_all_restraints 0.2914
_Distance_constraint_stats_list.Viol_average_violations_only 2.2782
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 8.813 0.720 16 3 "[ . -1 .+ *]"
1 2 GLN 169.716 7.145 5 20 [****+-**************]
1 3 THR 2.479 0.150 15 0 "[ . 1 . 2]"
1 4 ILE 102.591 2.400 18 20 [***************-*+**]
1 5 LYS 1.106 0.120 5 0 "[ . 1 . 2]"
1 6 CYS 52.487 3.412 10 20 [********-+**********]
1 7 VAL 103.510 5.463 19 20 [*****************-+*]
1 8 VAL 74.014 4.002 15 20 [**************+***-*]
1 9 VAL 136.942 5.267 16 20 [-**************+****]
1 10 GLY 189.730 4.849 13 20 [************+*-*****]
1 11 ASP 83.906 4.601 4 20 [***+********-*******]
1 12 GLY 73.859 4.468 19 20 [******************+*]
1 13 ALA 329.577 8.827 13 20 [************+*****-*]
1 15 GLY 0.722 0.120 5 0 "[ . 1 . 2]"
1 16 LYS 2.129 0.290 16 0 "[ . 1 . 2]"
1 17 THR 352.513 8.071 14 20 [*************+-*****]
1 18 CYS 125.575 4.601 4 20 [***+****-***********]
1 19 LEU 179.253 2.942 20 20 [***************-***+]
1 20 LEU 163.019 7.145 5 20 [****+*********-*****]
1 21 ILE 5.442 0.269 19 0 "[ . 1 . 2]"
1 22 SER 70.672 4.468 19 20 [***************-**+*]
1 23 TYR 59.716 2.955 2 20 [*+******-***********]
1 24 THR 0.369 0.075 12 0 "[ . 1 . 2]"
1 25 THR 129.448 4.949 20 20 [**********-********+]
1 26 ASN 60.785 2.955 2 20 [-+******************]
1 27 LYS 262.637 5.463 19 20 [**************-***+*]
1 28 PHE 241.512 5.246 13 20 [************+-******]
1 29 PRO 132.493 2.942 20 20 [*****-*************+]
1 30 SER 101.584 5.690 11 20 [**********+*-*******]
1 31 GLU 480.973 7.442 9 20 [********+*****-*****]
1 32 TYR 281.249 7.697 19 20 [******-***********+*]
1 33 VAL 129.756 4.002 15 20 [*-************+*****]
1 34 PRO 145.385 4.468 19 20 [******************+*]
1 35 THR 253.690 4.949 20 20 [******-************+]
1 36 VAL 198.132 7.442 9 20 [********+*********-*]
1 37 PHE 295.487 7.697 19 20 [*******-**********+*]
1 38 ASP 439.595 12.237 11 20 [*******-**+*********]
1 39 ASN 101.912 4.692 6 20 [*****+*******-******]
1 40 TYR 426.490 17.950 20 20 [**-****************+]
1 41 ALA 100.665 5.463 19 20 [*****************-+*]
1 42 VAL 1.355 0.123 11 0 "[ . 1 . 2]"
1 43 THR 8.749 0.328 18 0 "[ . 1 . 2]"
1 44 VAL 94.704 2.942 20 20 [******-************+]
1 45 MET 306.170 8.071 14 20 [********-****+******]
1 46 ILE 76.595 4.849 13 20 [*******-****+*******]
1 47 GLY 4.689 0.328 18 0 "[ . 1 . 2]"
1 48 GLY 2.093 0.150 15 0 "[ . 1 . 2]"
1 49 GLU 278.002 7.145 5 20 [***-+***************]
1 50 PRO 0.384 0.098 12 0 "[ . 1 . 2]"
1 51 TYR 129.468 7.442 9 20 [********+****-******]
1 52 THR 34.793 2.582 1 20 [+*************-*****]
1 53 LEU 75.479 4.002 15 20 [**************+***-*]
1 54 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 LEU 77.608 4.002 15 20 [**************+***-*]
1 56 PHE 52.757 3.412 10 20 [********-+**********]
1 57 ASP 2.556 0.225 15 0 "[ . 1 . 2]"
1 58 THR 176.871 3.828 8 20 [-******+************]
1 59 ALA 311.529 7.442 9 20 [********+*****-*****]
1 61 LEU 133.344 5.089 15 20 [**********-***+*****]
1 62 GLU 93.234 2.942 20 20 [******-************+]
1 63 ASP 206.164 7.442 9 20 [********+*****-*****]
1 64 TYR 4.071 0.273 17 0 "[ . 1 . 2]"
1 65 ASP 40.407 2.002 2 20 [*+**************-***]
1 66 ARG 68.988 2.582 1 20 [+*************-*****]
1 67 LEU 44.637 2.122 12 20 [***********+******-*]
1 68 ARG 2.134 0.175 10 0 "[ . 1 . 2]"
1 69 PRO 2.778 0.459 18 0 "[ . 1 . 2]"
1 70 LEU 150.428 6.047 3 20 [**+****-************]
1 71 SER 30.596 2.582 1 20 [+*************-*****]
1 72 TYR 244.450 7.697 19 20 [***********-******+*]
1 73 PRO 70.614 2.446 14 20 [-************+******]
1 74 GLN 206.466 7.145 5 20 [***-+***************]
1 75 THR 243.327 9.472 7 20 [******+***********-*]
1 76 ASP 0.722 0.120 5 0 "[ . 1 . 2]"
1 77 VAL 189.696 5.246 13 20 [*****-******+*******]
1 78 PHE 244.541 7.697 19 20 [***********-******+*]
1 79 LEU 866.542 19.014 20 20 [*****************-*+]
1 80 VAL 105.135 2.446 14 20 [*************+*-****]
1 81 CYS 135.820 7.145 5 20 [****+***-***********]
1 82 PHE 9.737 0.546 10 3 "[- .* + . 2]"
1 83 SER 124.348 3.828 8 20 [*******+******-*****]
1 84 VAL 231.321 5.246 13 20 [*********-**+*******]
1 85 VAL 176.139 5.089 15 20 [**************+-****]
1 86 SER 512.718 12.237 11 20 [**********+*-*******]
1 87 PRO 0.830 0.161 10 0 "[ . 1 . 2]"
1 88 SER 4.009 0.328 18 0 "[ . 1 . 2]"
1 89 SER 483.030 17.950 20 20 [**************-****+]
1 90 PHE 5.629 0.328 18 0 "[ . 1 . 2]"
1 91 GLU 265.333 7.145 5 20 [****+********-******]
1 92 ASN 662.227 19.014 20 20 [*************-*****+]
1 93 VAL 106.749 5.463 19 20 [*****************-+*]
1 94 LYS 186.846 5.463 19 20 [*************-****+*]
1 95 GLU 116.889 4.949 20 20 [***-***************+]
1 96 LYS 127.004 4.002 15 20 [***-**********+*****]
1 97 TRP 88.245 4.949 20 20 [**********-********+]
1 98 VAL 295.148 7.145 5 20 [****+**********-****]
1 99 PRO 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 GLU 37.362 2.008 16 20 [********-******+****]
1 101 ILE 2.862 0.172 15 0 "[ . 1 . 2]"
1 102 THR 97.314 2.942 20 20 [******-************+]
1 103 HIS 450.052 12.237 11 20 [**********+*****-***]
1 104 HIS 306.389 11.266 7 20 [******+*************]
1 105 CYS 76.325 4.468 19 20 [******************+*]
1 106 PRO 146.642 5.267 16 20 [********-******+****]
1 107 LYS 432.121 7.442 9 20 [*****-**+***********]
1 108 THR 827.889 19.014 20 20 [*******-***********+]
1 109 PRO 49.604 2.549 14 20 [-************+******]
1 110 PHE 144.211 7.697 19 20 [**************-***+*]
1 111 LEU 154.793 5.246 13 20 [*******-****+*******]
1 112 LEU 155.214 4.868 13 20 [*****-******+*******]
1 113 VAL 116.332 4.692 6 20 [*****+**************]
1 114 GLY 2.949 0.459 18 0 "[ . 1 . 2]"
1 115 THR 32.543 2.400 18 20 [***************-*+**]
1 116 GLN 86.031 3.412 10 20 [*********+****-*****]
1 117 ILE 91.945 4.949 20 20 [**********-********+]
1 118 ASP 140.744 5.089 15 20 [**************+*****]
1 119 LEU 104.187 4.002 15 20 [*************-+*****]
1 120 ARG 33.825 1.862 8 20 [*******+**********-*]
1 121 ASP 644.455 19.014 20 20 [*****************-*+]
1 122 ASP 83.090 4.601 4 20 [***+********-*******]
1 123 PRO 300.276 7.145 5 20 [-***+***************]
1 124 SER 33.869 2.582 1 20 [+*************-*****]
1 125 THR 180.658 5.463 19 20 [*********-********+*]
1 126 ILE 240.683 5.267 16 20 [***************+**-*]
1 127 GLU 141.876 2.549 14 20 [***-*********+******]
1 128 LYS 36.280 1.862 8 20 [*******+*****-******]
1 129 LEU 230.723 7.442 9 20 [********+******-****]
1 130 ALA 3.501 0.257 17 0 "[ . 1 . 2]"
1 131 LYS 98.718 5.267 16 20 [****-**********+****]
1 132 ASN 241.282 7.697 19 20 [***********-******+*]
1 133 LYS 100.541 2.663 18 20 [*************-***+**]
1 134 GLN 748.590 19.014 20 20 [*************-*****+]
1 135 LYS 804.622 19.014 20 20 [****************-**+]
1 136 PRO 130.031 5.089 15 20 [**********-***+*****]
1 137 ILE 351.324 7.442 9 20 [****-***+***********]
1 138 THR 421.912 5.690 11 20 [**********+*******-*]
1 139 PRO 160.670 8.071 14 20 [********-****+******]
1 140 GLU 239.531 5.267 16 20 [**************-+****]
1 141 THR 34.078 2.582 1 20 [+*************-*****]
1 142 ALA 1.368 0.167 6 0 "[ . 1 . 2]"
1 143 GLU 270.830 8.071 14 20 [********-****+******]
1 144 LYS 213.193 7.442 9 20 [********+****-******]
1 145 LEU 78.282 4.849 13 20 [*******-****+*******]
1 146 ALA 103.753 6.047 3 20 [**+********-********]
1 147 ARG 735.224 12.237 11 20 [**********+**-******]
1 148 ASP 127.765 7.145 5 20 [****+*******-*******]
1 149 LEU 49.857 2.956 9 20 [****-***+***********]
1 150 LYS 275.831 7.442 9 20 [***-****+***********]
1 151 ALA 3.075 0.175 10 0 "[ . 1 . 2]"
1 152 VAL 105.124 4.002 15 20 [*************-+*****]
1 153 LYS 124.496 4.601 4 20 [***+*-**************]
1 154 TYR 83.758 4.601 4 20 [***+********-*******]
1 155 VAL 90.644 5.267 16 20 [****-**********+****]
1 156 GLU 309.885 7.442 9 20 [***-****+***********]
1 157 CYS 1.060 0.123 11 0 "[ . 1 . 2]"
1 158 SER 30.271 2.582 1 20 [+*************-*****]
1 159 ALA 92.926 2.942 20 20 [******-************+]
1 160 LEU 1.825 0.184 8 0 "[ . 1 . 2]"
1 161 THR 291.455 5.690 11 20 [**********+*********]
1 162 GLN 258.435 7.145 5 20 [****+-**************]
1 163 LYS 135.290 5.463 19 20 [*************-****+*]
1 164 GLY 0.031 0.025 7 0 "[ . 1 . 2]"
1 165 LEU 4.526 0.259 14 0 "[ . 1 . 2]"
1 166 LYS 158.732 7.442 9 20 [********+*****-*****]
1 167 ASN 171.482 5.690 11 20 [**********+*****-***]
1 168 VAL 5.407 0.290 16 0 "[ . 1 . 2]"
1 169 PHE 139.922 7.697 19 20 [**************-***+*]
1 170 ASP 100.436 2.942 20 20 [********-**********+]
1 171 GLU 207.833 5.690 11 20 [**********+*******-*]
1 172 ALA 237.590 5.690 11 20 [-*********+*********]
1 173 ILE 181.649 4.849 13 20 [************+**-****]
1 174 LEU 22.558 2.663 18 20 [*************-***+**]
1 175 ALA 1.540 0.174 4 0 "[ . 1 . 2]"
1 176 ALA 109.027 4.849 13 20 [************+*-*****]
1 177 LEU 650.065 12.237 11 20 [**********+**-******]
1 178 GLU 86.165 4.949 20 20 [**********-********+]
1 179 PRO 802.311 19.014 20 20 [-******************+]
1 180 PRO 219.450 5.267 16 20 [**********-****+****]
1 181 GLU 88.870 5.267 16 20 [****-**********+****]
1 182 PRO 86.266 2.956 9 20 [****-***+***********]
1 183 LYS 171.661 7.442 9 20 [****-***+***********]
1 184 LYS 284.088 5.690 11 20 [**********+*****-***]
2 1 GLY 4.000 0.459 18 0 "[ . 1 . 2]"
2 2 SER 50.624 3.280 3 20 [**+***********-*****]
2 3 ILE 141.521 4.002 15 20 [**************+**-**]
2 4 SER 51.070 3.280 3 20 [**+***********-*****]
2 5 LEU 384.009 13.859 15 20 [*************-+*****]
2 6 PRO 266.431 8.827 13 20 [************+**-****]
2 7 SER 139.864 5.246 13 20 [************+****-**]
2 8 ASP 0.264 0.101 6 0 "[ . 1 . 2]"
2 9 PHE 253.780 6.047 3 20 [**+***************-*]
2 10 GLU 295.931 7.442 9 20 [*****-**+***********]
2 11 HIS 100.459 6.047 3 20 [**+********-********]
2 12 THR 143.699 5.690 11 20 [**********+*******-*]
2 13 ILE 464.641 12.113 20 20 [***************-***+]
2 14 HIS 352.066 19.014 20 20 [*****-*************+]
2 15 VAL 75.188 4.002 15 20 [**************+***-*]
2 16 GLY 0.903 0.120 5 0 "[ . 1 . 2]"
2 17 PHE 131.930 4.601 4 20 [***+***-************]
2 18 ASP 137.260 7.145 5 20 [-***+***************]
2 19 ALA 112.403 4.002 15 20 [-*************+*****]
2 20 VAL 7.176 0.459 18 0 "[ . 1 . 2]"
2 21 THR 93.390 2.942 20 20 [******-************+]
2 22 GLY 0.667 0.074 12 0 "[ . 1 . 2]"
2 23 GLU 280.007 7.145 5 20 [***-+***************]
2 24 PHE 43.607 2.002 2 20 [*+********-*********]
2 25 THR 93.267 2.942 20 20 [******-************+]
2 26 GLY 41.826 2.002 2 20 [*+********-*********]
2 27 MET 551.177 8.071 14 20 [********-****+******]
2 28 PRO 428.864 5.463 19 20 [******************+*]
2 29 GLU 140.364 2.549 14 20 [***-*********+******]
2 30 GLN 335.481 8.071 14 20 [********-****+******]
2 31 TRP 353.515 13.859 15 20 [-*************+*****]
2 32 ALA 134.307 5.690 11 20 [**********+***-*****]
2 33 ARG 205.440 7.442 9 20 [********+****-******]
2 34 LEU 213.218 7.442 9 20 [****-***+***********]
2 35 LEU 67.435 2.400 18 20 [***************-*+**]
2 36 GLN 403.804 8.071 14 20 [********-****+******]
2 37 THR 208.344 5.690 11 20 [**********+*******-*]
2 38 SER 75.556 3.280 3 20 [**+**********-******]
2 39 ASN 319.986 6.047 3 20 [**+**************-**]
2 40 ILE 330.065 5.690 11 20 [****-*****+*********]
2 41 THR 96.212 2.942 20 20 [******-************+]
2 42 LYS 174.850 7.442 9 20 [****-***+***********]
2 43 SER 91.657 3.280 3 20 [**+***********-*****]
2 44 GLU 117.523 5.267 16 20 [***-***********+****]
2 45 GLN 159.067 2.955 2 20 [-+******************]
2 46 LYS 265.923 7.442 9 20 [********+*********-*]
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 4 ILE QG 2 10 GLU QB 5.000 . 5.000 3.916 2.162 4.649 . 0 0 "[ . 1 . 2]" 2
2 1 7 VAL QG 2 10 GLU QB 3.500 . 3.500 3.302 1.786 3.607 0.107 18 0 "[ . 1 . 2]" 2
3 1 4 ILE QG 2 10 GLU QB 5.000 . 5.000 3.903 2.162 4.646 . 0 0 "[ . 1 . 2]" 2
4 1 7 VAL QG 2 10 GLU QB 5.000 . 5.000 3.303 1.786 3.610 . 0 0 "[ . 1 . 2]" 2
5 1 32 TYR QD 2 30 GLN QG 5.000 . 5.000 3.721 1.912 4.310 . 0 0 "[ . 1 . 2]" 2
6 1 32 TYR QD 2 30 GLN QG 5.000 . 5.000 3.720 1.912 4.309 . 0 0 "[ . 1 . 2]" 2
7 1 33 VAL H 2 2 SER QB 5.000 . 5.000 2.274 1.776 3.056 . 0 0 "[ . 1 . 2]" 2
8 1 27 LYS QD 2 2 SER QB 5.000 . 5.000 3.186 2.299 3.582 . 0 0 "[ . 1 . 2]" 2
9 1 7 VAL QG 2 2 SER QB 5.000 . 5.000 3.845 2.923 4.525 . 0 0 "[ . 1 . 2]" 2
10 1 1 MET QB 2 3 ILE MD 5.000 . 5.000 2.326 2.028 2.661 . 0 0 "[ . 1 . 2]" 2
11 1 1 MET QG 2 3 ILE MD 5.000 . 5.000 3.401 2.182 3.998 . 0 0 "[ . 1 . 2]" 2
12 1 17 THR HB 2 3 ILE MD 5.000 . 5.000 4.851 4.299 5.056 0.056 11 0 "[ . 1 . 2]" 2
13 1 29 PRO HA 2 3 ILE MD 3.500 . 3.500 2.084 1.836 2.682 . 0 0 "[ . 1 . 2]" 2
14 1 46 ILE QG 2 3 ILE MD 5.000 . 5.000 2.203 1.769 3.181 . 0 0 "[ . 1 . 2]" 2
15 1 2 GLN QB 2 3 ILE MD 3.500 . 3.500 2.906 2.049 3.472 . 0 0 "[ . 1 . 2]" 2
16 1 24 THR HB 2 3 ILE MD 5.000 . 5.000 3.821 2.897 4.312 . 0 0 "[ . 1 . 2]" 2
17 1 19 LEU HA 2 3 ILE MD 5.000 . 5.000 4.917 4.298 5.066 0.066 19 0 "[ . 1 . 2]" 2
18 1 17 THR HB 2 3 ILE MG 5.000 . 5.000 3.562 3.318 3.799 . 0 0 "[ . 1 . 2]" 2
19 1 2 GLN QB 2 3 ILE MG 5.000 . 5.000 3.983 2.959 4.614 . 0 0 "[ . 1 . 2]" 2
20 1 1 MET QB 2 3 ILE MG 5.000 . 5.000 3.656 2.922 4.302 . 0 0 "[ . 1 . 2]" 2
21 1 1 MET QG 2 3 ILE MG 5.000 . 5.000 2.631 1.879 3.681 . 0 0 "[ . 1 . 2]" 2
22 1 29 PRO HA 2 3 ILE MG 5.000 . 5.000 2.546 1.931 3.524 . 0 0 "[ . 1 . 2]" 2
23 1 7 VAL QG 2 3 ILE MG 2.800 . 2.800 2.230 1.747 2.656 . 0 0 "[ . 1 . 2]" 2
24 2 5 LEU QD 2 31 TRP QB 5.000 . 5.000 17.218 16.231 18.859 13.859 15 20 [**************+****-] 2
25 1 79 LEU HA 2 5 LEU QD 5.000 . 5.000 4.592 3.790 4.882 . 0 0 "[ . 1 . 2]" 2
26 1 24 THR HA 2 5 LEU QD 5.000 . 5.000 1.880 1.685 2.119 . 0 0 "[ . 1 . 2]" 2
27 1 1 MET QB 2 5 LEU QD 5.000 . 5.000 3.162 2.014 3.989 . 0 0 "[ . 1 . 2]" 2
28 1 26 ASN QB 2 5 LEU QD 5.000 . 5.000 4.699 3.674 4.971 . 0 0 "[ . 1 . 2]" 2
29 1 27 LYS QB 2 5 LEU QD 5.000 . 5.000 3.347 2.388 4.013 . 0 0 "[ . 1 . 2]" 2
30 1 2 GLN QB 2 5 LEU QD 3.500 . 3.500 3.522 3.429 3.579 0.079 17 0 "[ . 1 . 2]" 2
31 1 43 THR H 2 6 PRO QB 5.000 . 5.000 1.970 1.676 2.224 . 0 0 "[ . 1 . 2]" 2
32 1 43 THR H 2 6 PRO QB 5.000 . 5.000 1.970 1.676 2.224 . 0 0 "[ . 1 . 2]" 2
33 1 2 GLN QB 2 6 PRO QB 5.000 . 5.000 4.745 4.309 5.049 0.049 3 0 "[ . 1 . 2]" 2
34 1 4 ILE QG 2 6 PRO QG 5.000 . 5.000 2.100 1.833 2.478 . 0 0 "[ . 1 . 2]" 2
35 1 13 ALA MB 2 6 PRO QG 5.000 . 5.000 4.833 4.729 4.930 . 0 0 "[ . 1 . 2]" 2
36 1 4 ILE QG 2 6 PRO QG 5.000 . 5.000 4.743 4.322 4.990 . 0 0 "[ . 1 . 2]" 2
37 1 4 ILE QG 2 6 PRO QG 5.000 . 5.000 2.100 1.833 2.478 . 0 0 "[ . 1 . 2]" 2
38 1 2 GLN HA 2 7 SER QB 5.000 . 5.000 4.038 3.650 4.509 . 0 0 "[ . 1 . 2]" 2
39 1 2 GLN HA 2 7 SER QB 5.000 . 5.000 4.038 3.650 4.508 . 0 0 "[ . 1 . 2]" 2
40 1 25 THR HB 2 8 ASP HA 5.000 . 5.000 3.995 3.614 4.440 . 0 0 "[ . 1 . 2]" 2
41 1 4 ILE QG 2 9 PHE QB 6.000 . 6.000 3.134 2.378 4.037 . 0 0 "[ . 1 . 2]" 2
42 1 4 ILE QG 2 9 PHE QB 5.000 . 5.000 3.127 2.389 4.010 . 0 0 "[ . 1 . 2]" 2
43 1 8 VAL QG 2 9 PHE QD 5.000 . 5.000 2.836 1.840 3.950 . 0 0 "[ . 1 . 2]" 2
44 1 25 THR MG 2 9 PHE QD 5.000 . 5.000 3.215 1.900 4.514 . 0 0 "[ . 1 . 2]" 2
45 1 21 ILE MD 2 9 PHE QE 5.000 . 5.000 2.419 1.999 2.954 . 0 0 "[ . 1 . 2]" 2
46 1 7 VAL QG 2 10 GLU QG 5.000 . 5.000 2.393 1.842 4.233 . 0 0 "[ . 1 . 2]" 2
47 1 11 ASP HA 2 10 GLU QG 5.000 . 5.000 4.127 3.642 5.104 0.104 19 0 "[ . 1 . 2]" 2
48 1 19 LEU HA 2 10 GLU QG 5.000 . 5.000 3.781 2.884 4.819 . 0 0 "[ . 1 . 2]" 2
49 1 7 VAL QG 2 10 GLU QG 5.000 . 5.000 2.393 1.842 4.233 . 0 0 "[ . 1 . 2]" 2
50 1 19 LEU HA 2 10 GLU QG 5.000 . 5.000 3.781 2.884 4.819 . 0 0 "[ . 1 . 2]" 2
51 1 21 ILE QG 2 12 THR HB 5.000 . 5.000 2.764 2.437 3.397 . 0 0 "[ . 1 . 2]" 2
52 1 1 MET QB 2 12 THR HB 5.000 . 5.000 4.590 4.013 4.984 . 0 0 "[ . 1 . 2]" 2
53 1 4 ILE MD 2 12 THR HB 5.000 . 5.000 2.389 1.858 4.037 . 0 0 "[ . 1 . 2]" 2
54 1 5 LYS HA 2 12 THR MG 5.000 . 5.000 4.498 3.483 5.090 0.090 10 0 "[ . 1 . 2]" 2
55 1 27 LYS H 2 13 ILE HB 5.000 . 5.000 2.849 2.595 3.025 . 0 0 "[ . 1 . 2]" 2
56 1 39 ASN QB 2 13 ILE HB 5.000 . 5.000 3.103 2.444 3.531 . 0 0 "[ . 1 . 2]" 2
57 1 1 MET ME 2 13 ILE HB 5.000 . 5.000 3.038 2.436 3.405 . 0 0 "[ . 1 . 2]" 2
58 1 26 ASN QB 2 13 ILE MD 5.000 . 5.000 4.156 3.439 4.698 . 0 0 "[ . 1 . 2]" 2
59 1 12 GLY QA 2 13 ILE MD 5.000 . 5.000 4.295 3.525 4.971 . 0 0 "[ . 1 . 2]" 2
60 1 43 THR HB 2 13 ILE MD 5.000 . 5.000 2.389 1.858 4.032 . 0 0 "[ . 1 . 2]" 2
61 1 7 VAL QG 2 13 ILE MD 5.000 . 5.000 2.729 1.926 3.507 . 0 0 "[ . 1 . 2]" 2
62 1 79 LEU HA 2 13 ILE MD 5.000 . 5.000 7.649 7.001 8.053 3.053 15 20 [**************+**-**] 2
63 1 36 VAL QG 2 13 ILE MD 5.000 . 5.000 2.727 1.926 3.505 . 0 0 "[ . 1 . 2]" 2
64 1 27 LYS H 2 13 ILE QG 5.000 . 5.000 4.536 4.198 4.799 . 0 0 "[ . 1 . 2]" 2
65 1 45 MET ME 2 13 ILE QG 3.500 . 3.500 5.826 4.936 6.456 2.956 9 20 [****-***+***********] 2
66 1 25 THR HB 2 13 ILE QG 5.000 . 5.000 2.764 2.437 3.394 . 0 0 "[ . 1 . 2]" 2
67 1 11 ASP H 2 13 ILE MG 5.000 . 5.000 3.667 3.347 3.971 . 0 0 "[ . 1 . 2]" 2
68 1 55 LEU HA 2 13 ILE MG 5.000 . 5.000 4.126 3.653 4.566 . 0 0 "[ . 1 . 2]" 2
69 1 36 VAL QG 2 13 ILE MG 5.000 . 5.000 2.476 1.861 3.787 . 0 0 "[ . 1 . 2]" 2
70 1 7 VAL QG 2 13 ILE MG 5.000 . 5.000 2.475 1.860 3.754 . 0 0 "[ . 1 . 2]" 2
71 1 51 TYR QB 2 13 ILE MG 5.000 . 5.000 2.529 1.818 3.560 . 0 0 "[ . 1 . 2]" 2
72 1 12 GLY QA 2 13 ILE MG 5.000 . 5.000 2.564 1.834 3.821 . 0 0 "[ . 1 . 2]" 2
73 1 79 LEU HA 2 13 ILE MG 5.000 . 5.000 5.058 5.001 5.147 0.147 18 0 "[ . 1 . 2]" 2
74 1 33 VAL QG 2 14 HIS HA 5.000 . 5.000 3.493 2.791 3.639 . 0 0 "[ . 1 . 2]" 2
75 1 12 GLY QA 2 15 VAL QG 5.000 . 5.000 1.867 1.723 2.160 . 0 0 "[ . 1 . 2]" 2
76 1 46 ILE MG 2 15 VAL QG 3.500 . 3.500 3.485 3.158 3.602 0.102 18 0 "[ . 1 . 2]" 2
77 1 34 PRO QB 2 15 VAL QG 5.000 . 5.000 4.804 4.513 4.936 . 0 0 "[ . 1 . 2]" 2
78 1 26 ASN QB 2 15 VAL QG 5.000 . 5.000 1.608 1.547 1.702 . 0 0 "[ . 1 . 2]" 2
79 1 26 ASN QB 2 15 VAL QG 5.000 . 5.000 1.608 1.547 1.702 . 0 0 "[ . 1 . 2]" 2
80 1 27 LYS H 2 15 VAL QG 3.500 . 3.500 2.176 1.964 2.542 . 0 0 "[ . 1 . 2]" 2
81 1 55 LEU QB 2 15 VAL QG 5.000 . 5.000 2.485 2.303 2.660 . 0 0 "[ . 1 . 2]" 2
82 1 36 VAL QG 2 15 VAL QG 5.000 . 5.000 1.882 1.630 2.131 . 0 0 "[ . 1 . 2]" 2
83 1 34 PRO QB 2 15 VAL QG 5.000 . 5.000 4.882 4.566 4.995 . 0 0 "[ . 1 . 2]" 2
84 1 37 PHE HA 2 15 VAL QG 5.000 . 5.000 3.025 2.931 3.163 . 0 0 "[ . 1 . 2]" 2
85 1 21 ILE QG 2 17 PHE QD 5.000 . 5.000 4.073 3.009 4.714 . 0 0 "[ . 1 . 2]" 2
86 1 32 TYR QD 2 17 PHE QD 5.000 . 5.000 3.781 2.898 4.542 . 0 0 "[ . 1 . 2]" 2
87 1 2 GLN QE 2 17 PHE QD 5.000 . 5.000 3.272 2.593 4.175 . 0 0 "[ . 1 . 2]" 2
88 1 19 LEU HA 2 17 PHE QE 5.000 . 5.000 4.016 3.395 4.784 . 0 0 "[ . 1 . 2]" 2
89 1 32 TYR QD 2 17 PHE QE 5.000 . 5.000 4.094 2.874 4.775 . 0 0 "[ . 1 . 2]" 2
90 1 20 LEU QD 2 18 ASP QB 5.000 . 5.000 1.816 1.631 2.126 . 0 0 "[ . 1 . 2]" 2
91 1 20 LEU QD 2 18 ASP QB 5.000 . 5.000 1.816 1.631 2.126 . 0 0 "[ . 1 . 2]" 2
92 1 4 ILE QG 2 19 ALA HA 5.000 . 5.000 4.281 3.914 4.669 . 0 0 "[ . 1 . 2]" 2
93 1 9 VAL HA 2 19 ALA HA 5.000 . 5.000 4.386 4.343 4.455 . 0 0 "[ . 1 . 2]" 2
94 1 20 LEU QD 2 19 ALA MB 5.000 . 5.000 5.033 4.933 5.121 0.121 3 0 "[ . 1 . 2]" 2
95 1 9 VAL HA 2 19 ALA MB 3.500 . 3.500 3.966 3.904 4.046 0.546 10 3 "[- .* + . 2]" 2
96 1 12 GLY QA 2 19 ALA MB 5.000 . 5.000 4.206 3.636 4.823 . 0 0 "[ . 1 . 2]" 2
97 1 49 GLU QG 2 19 ALA MB 5.000 . 5.000 6.444 5.902 7.008 2.008 16 20 [***-***********+****] 2
98 1 8 VAL QG 2 19 ALA MB 3.500 . 3.500 7.100 6.641 7.502 4.002 15 20 [**************+***-*] 2
99 1 27 LYS H 2 19 ALA MB 5.000 . 5.000 4.360 3.237 5.005 0.005 16 0 "[ . 1 . 2]" 2
100 1 11 ASP QB 2 19 ALA MB 6.000 . 6.000 5.605 4.745 6.045 0.045 17 0 "[ . 1 . 2]" 2
101 1 120 ARG H 2 19 ALA MB 5.000 . 5.000 4.408 4.216 4.904 . 0 0 "[ . 1 . 2]" 2
102 1 21 ILE QG 2 20 VAL HA 5.000 . 5.000 4.003 3.857 4.119 . 0 0 "[ . 1 . 2]" 2
103 1 8 VAL QG 2 20 VAL HA 5.000 . 5.000 4.441 3.590 4.834 . 0 0 "[ . 1 . 2]" 2
104 1 20 LEU QD 2 20 VAL HB 5.000 . 5.000 4.684 4.160 4.996 . 0 0 "[ . 1 . 2]" 2
105 1 21 ILE QG 2 20 VAL HB 5.000 . 5.000 4.774 4.485 5.038 0.038 1 0 "[ . 1 . 2]" 2
106 1 17 THR HA 2 20 VAL QG 5.000 . 5.000 2.947 2.257 3.869 . 0 0 "[ . 1 . 2]" 2
107 1 21 ILE QG 2 20 VAL QG 5.000 . 5.000 3.812 2.914 4.739 . 0 0 "[ . 1 . 2]" 2
108 1 1 MET QB 2 20 VAL QG 5.000 . 5.000 4.832 4.128 4.991 . 0 0 "[ . 1 . 2]" 2
109 1 21 ILE QG 2 20 VAL QG 3.500 . 3.500 3.485 2.874 3.623 0.123 18 0 "[ . 1 . 2]" 2
110 1 17 THR HA 2 20 VAL QG 5.000 . 5.000 2.947 2.257 3.869 . 0 0 "[ . 1 . 2]" 2
111 1 9 VAL HA 2 20 VAL QG 5.000 . 5.000 4.023 3.665 4.356 . 0 0 "[ . 1 . 2]" 2
112 1 2 GLN QG 2 21 THR HB 5.000 . 5.000 4.292 3.680 4.831 . 0 0 "[ . 1 . 2]" 2
113 1 48 GLY QA 2 21 THR MG 5.000 . 5.000 4.531 3.606 4.988 . 0 0 "[ . 1 . 2]" 2
114 1 20 LEU HG 2 21 THR MG 3.500 . 3.500 2.242 1.688 3.554 0.054 14 0 "[ . 1 . 2]" 2
115 1 27 LYS H 2 21 THR MG 5.000 . 5.000 2.872 2.266 4.596 . 0 0 "[ . 1 . 2]" 2
116 1 10 GLY H 2 22 GLY QA 5.000 . 5.000 4.012 3.394 4.775 . 0 0 "[ . 1 . 2]" 2
117 1 10 GLY H 2 22 GLY QA 6.000 . 6.000 4.013 3.394 4.777 . 0 0 "[ . 1 . 2]" 2
118 1 29 PRO HA 2 23 GLU QG 5.000 . 5.000 4.172 3.650 4.646 . 0 0 "[ . 1 . 2]" 2
119 1 4 ILE HA 2 24 PHE HA 5.000 . 5.000 6.938 6.843 7.002 2.002 2 20 [*+********-*********] 2
120 1 29 PRO HA 2 24 PHE HA 6.000 . 6.000 5.249 5.060 5.321 . 0 0 "[ . 1 . 2]" 2
121 1 20 LEU QD 2 24 PHE HA 5.000 . 5.000 3.303 3.139 3.471 . 0 0 "[ . 1 . 2]" 2
122 1 64 TYR QE 2 24 PHE QD 5.000 . 5.000 3.211 2.585 4.067 . 0 0 "[ . 1 . 2]" 2
123 1 4 ILE MD 2 24 PHE QE 5.000 . 5.000 3.928 2.906 4.529 . 0 0 "[ . 1 . 2]" 2
124 1 64 TYR QE 2 24 PHE QE 5.000 . 5.000 3.304 2.799 4.059 . 0 0 "[ . 1 . 2]" 2
125 1 64 TYR QE 2 24 PHE HZ 5.000 . 5.000 4.040 2.689 4.876 . 0 0 "[ . 1 . 2]" 2
126 1 40 TYR HA 2 25 THR MG 5.000 . 5.000 3.887 3.508 4.305 . 0 0 "[ . 1 . 2]" 2
127 1 52 THR H 2 25 THR MG 3.500 . 3.500 3.388 3.112 3.511 0.011 18 0 "[ . 1 . 2]" 2
128 1 2 GLN QG 2 25 THR MG 3.500 . 3.500 1.815 1.629 2.125 . 0 0 "[ . 1 . 2]" 2
129 1 37 PHE HA 2 26 GLY QA 5.000 . 5.000 4.052 3.953 4.141 . 0 0 "[ . 1 . 2]" 2
130 1 20 LEU QD 2 27 MET QB 5.000 . 5.000 3.530 1.834 4.324 . 0 0 "[ . 1 . 2]" 2
131 1 55 LEU HA 2 27 MET ME 5.000 . 5.000 4.888 4.276 5.005 0.005 18 0 "[ . 1 . 2]" 2
132 1 19 LEU HA 2 27 MET ME 3.500 . 3.500 3.436 3.174 3.547 0.047 13 0 "[ . 1 . 2]" 2
133 1 36 VAL QG 2 27 MET ME 3.500 . 3.500 2.969 2.703 3.296 . 0 0 "[ . 1 . 2]" 2
134 1 83 SER H 2 27 MET ME 3.500 . 3.500 3.412 2.999 3.578 0.078 18 0 "[ . 1 . 2]" 2
135 1 4 ILE MD 2 27 MET ME 2.800 . 2.800 2.642 2.157 2.849 0.049 3 0 "[ . 1 . 2]" 2
136 1 7 VAL QG 2 27 MET ME 5.000 . 5.000 3.992 3.554 4.575 . 0 0 "[ . 1 . 2]" 2
137 1 6 CYS QB 2 27 MET ME 3.500 . 3.500 2.218 1.670 2.753 . 0 0 "[ . 1 . 2]" 2
138 1 17 THR HB 2 27 MET ME 5.000 . 5.000 4.193 3.666 4.633 . 0 0 "[ . 1 . 2]" 2
139 1 20 LEU QD 2 27 MET ME 3.500 . 3.500 2.586 2.367 2.837 . 0 0 "[ . 1 . 2]" 2
140 1 79 LEU HA 2 27 MET ME 5.000 . 5.000 5.110 4.927 5.359 0.359 4 0 "[ . 1 . 2]" 2
141 1 52 THR H 2 27 MET ME 5.000 . 5.000 3.708 2.638 4.122 . 0 0 "[ . 1 . 2]" 2
142 1 4 ILE H 2 27 MET ME 5.000 . 5.000 4.917 4.865 4.990 . 0 0 "[ . 1 . 2]" 2
143 1 6 CYS QB 2 27 MET QG 5.000 . 5.000 3.740 2.871 4.109 . 0 0 "[ . 1 . 2]" 2
144 1 32 TYR QD 2 27 MET QG 5.000 . 5.000 4.457 4.198 4.876 . 0 0 "[ . 1 . 2]" 2
145 1 19 LEU HA 2 27 MET QG 5.000 . 5.000 3.446 1.778 4.074 . 0 0 "[ . 1 . 2]" 2
146 1 67 LEU QD 2 27 MET QG 5.000 . 5.000 4.292 3.780 4.665 . 0 0 "[ . 1 . 2]" 2
147 1 23 TYR QB 2 27 MET QG 5.000 . 5.000 3.740 2.871 4.109 . 0 0 "[ . 1 . 2]" 2
148 1 8 VAL HB 2 28 PRO HA 5.000 . 5.000 4.300 3.593 4.980 . 0 0 "[ . 1 . 2]" 2
149 1 7 VAL QG 2 28 PRO QG 5.000 . 5.000 2.480 1.861 3.812 . 0 0 "[ . 1 . 2]" 2
150 1 8 VAL HB 2 29 GLU HA 3.500 . 3.500 2.547 2.017 3.334 . 0 0 "[ . 1 . 2]" 2
151 1 17 THR HA 2 29 GLU QB 5.000 . 5.000 4.291 4.114 4.445 . 0 0 "[ . 1 . 2]" 2
152 1 21 ILE QG 2 29 GLU QB 5.000 . 5.000 4.264 3.916 4.726 . 0 0 "[ . 1 . 2]" 2
153 1 17 THR HA 2 29 GLU QB 5.000 . 5.000 4.291 4.114 4.444 . 0 0 "[ . 1 . 2]" 2
154 1 21 ILE QG 2 29 GLU QB 5.000 . 5.000 4.264 3.916 4.726 . 0 0 "[ . 1 . 2]" 2
155 1 17 THR HA 2 29 GLU QG 5.000 . 5.000 4.284 3.585 4.864 . 0 0 "[ . 1 . 2]" 2
156 1 17 THR HA 2 29 GLU QG 5.000 . 5.000 4.285 3.585 4.865 . 0 0 "[ . 1 . 2]" 2
157 1 21 ILE QG 2 30 GLN HA 5.000 . 5.000 4.993 4.892 5.044 0.044 9 0 "[ . 1 . 2]" 2
158 1 7 VAL QG 2 30 GLN QB 5.000 . 5.000 3.888 2.668 4.628 . 0 0 "[ . 1 . 2]" 2
159 1 7 VAL QG 2 30 GLN QG 5.000 . 5.000 2.781 1.853 4.707 . 0 0 "[ . 1 . 2]" 2
160 1 10 GLY QA 2 31 TRP HD1 6.000 . 6.000 4.986 4.476 5.306 . 0 0 "[ . 1 . 2]" 2
161 1 7 VAL QG 2 31 TRP HD1 5.000 . 5.000 4.315 2.612 4.788 . 0 0 "[ . 1 . 2]" 2
162 1 70 LEU H 2 31 TRP HE3 6.000 . 6.000 5.830 5.558 6.047 0.047 9 0 "[ . 1 . 2]" 2
163 1 17 THR HA 2 31 TRP HZ2 5.000 . 5.000 4.407 2.692 5.024 0.024 18 0 "[ . 1 . 2]" 2
164 1 2 GLN QE 2 31 TRP HZ2 5.000 . 5.000 4.087 3.302 4.937 . 0 0 "[ . 1 . 2]" 2
165 1 45 MET ME 2 32 ALA HA 5.000 . 5.000 2.797 1.876 4.154 . 0 0 "[ . 1 . 2]" 2
166 1 39 ASN QB 2 32 ALA HA 5.000 . 5.000 2.864 1.759 3.929 . 0 0 "[ . 1 . 2]" 2
167 1 68 ARG H 2 32 ALA MB 5.000 . 5.000 3.006 1.801 4.127 . 0 0 "[ . 1 . 2]" 2
168 1 32 TYR QD 2 32 ALA MB 5.000 . 5.000 4.284 4.167 4.390 . 0 0 "[ . 1 . 2]" 2
169 1 44 VAL H 2 32 ALA MB 5.000 . 5.000 4.826 4.560 5.045 0.045 14 0 "[ . 1 . 2]" 2
170 1 67 LEU QD 2 32 ALA MB 5.000 . 5.000 4.973 4.578 5.184 0.184 8 0 "[ . 1 . 2]" 2
171 1 45 MET ME 2 32 ALA MB 3.500 . 3.500 2.138 1.740 3.304 . 0 0 "[ . 1 . 2]" 2
172 1 3 THR HB 2 32 ALA MB 3.500 . 3.500 3.581 3.528 3.650 0.150 15 0 "[ . 1 . 2]" 2
173 1 1 MET QG 2 33 ARG QB 5.000 . 5.000 4.241 3.581 4.870 . 0 0 "[ . 1 . 2]" 2
174 1 7 VAL QG 2 33 ARG QB 5.000 . 5.000 3.753 2.992 4.701 . 0 0 "[ . 1 . 2]" 2
175 1 7 VAL QG 2 33 ARG QB 5.000 . 5.000 4.687 3.257 5.020 0.020 5 0 "[ . 1 . 2]" 2
176 1 21 ILE QG 2 33 ARG QB 5.000 . 5.000 4.004 3.507 4.315 . 0 0 "[ . 1 . 2]" 2
177 1 3 THR HB 2 33 ARG QD 3.500 . 3.500 2.744 1.931 3.278 . 0 0 "[ . 1 . 2]" 2
178 1 74 GLN QE 2 33 ARG QG 5.000 . 5.000 3.704 2.037 4.198 . 0 0 "[ . 1 . 2]" 2
179 1 49 GLU QG 2 33 ARG QG 5.000 . 5.000 4.528 3.851 4.851 . 0 0 "[ . 1 . 2]" 2
180 1 35 THR H 2 34 LEU QB 5.000 . 5.000 2.336 1.784 4.516 . 0 0 "[ . 1 . 2]" 2
181 1 66 ARG QD 2 34 LEU QD 5.000 . 5.000 4.175 3.388 4.471 . 0 0 "[ . 1 . 2]" 2
182 1 10 GLY H 2 34 LEU QD 5.000 . 5.000 3.608 2.520 4.208 . 0 0 "[ . 1 . 2]" 2
183 1 35 THR H 2 34 LEU QD 3.500 . 3.500 2.412 1.742 3.510 0.010 18 0 "[ . 1 . 2]" 2
184 1 6 CYS QB 2 34 LEU QD 6.000 . 6.000 5.763 4.605 6.026 0.026 6 0 "[ . 1 . 2]" 2
185 1 40 TYR QB 2 34 LEU QD 5.000 . 5.000 3.727 2.376 4.953 . 0 0 "[ . 1 . 2]" 2
186 1 10 GLY H 2 34 LEU QD 5.000 . 5.000 3.607 2.518 4.206 . 0 0 "[ . 1 . 2]" 2
187 1 4 ILE MD 2 34 LEU HG 5.000 . 5.000 4.274 3.728 4.827 . 0 0 "[ . 1 . 2]" 2
188 1 35 THR H 2 34 LEU HG 5.000 . 5.000 2.408 1.782 5.167 0.167 4 0 "[ . 1 . 2]" 2
189 1 24 THR H 2 35 LEU QB 6.000 . 6.000 5.429 5.229 5.623 . 0 0 "[ . 1 . 2]" 2
190 1 70 LEU QD 2 35 LEU QD 3.500 . 3.500 2.237 1.633 3.511 0.011 15 0 "[ . 1 . 2]" 2
191 1 3 THR MG 2 35 LEU QD 5.000 . 5.000 3.631 2.996 4.205 . 0 0 "[ . 1 . 2]" 2
192 1 46 ILE QG 2 35 LEU QD 5.000 . 5.000 2.168 1.650 3.256 . 0 0 "[ . 1 . 2]" 2
193 1 66 ARG QD 2 35 LEU QD 5.000 . 5.000 2.945 2.747 3.236 . 0 0 "[ . 1 . 2]" 2
194 1 43 THR HB 2 35 LEU QD 3.500 . 3.500 2.285 1.855 2.913 . 0 0 "[ . 1 . 2]" 2
195 1 17 THR HB 2 35 LEU QD 5.000 . 5.000 3.427 2.602 3.947 . 0 0 "[ . 1 . 2]" 2
196 1 32 TYR QD 2 35 LEU QD 5.000 . 5.000 3.811 2.875 4.372 . 0 0 "[ . 1 . 2]" 2
197 1 56 PHE QE 2 35 LEU QD 5.000 . 5.000 3.828 3.328 4.667 . 0 0 "[ . 1 . 2]" 2
198 1 66 ARG QG 2 35 LEU QD 2.800 . 2.800 1.753 1.594 1.817 . 0 0 "[ . 1 . 2]" 2
199 1 31 GLU HA 2 35 LEU QD 5.000 . 5.000 3.471 2.662 4.020 . 0 0 "[ . 1 . 2]" 2
200 1 46 ILE QG 2 35 LEU QD 3.500 . 3.500 2.167 1.650 3.255 . 0 0 "[ . 1 . 2]" 2
201 1 67 LEU QD 2 35 LEU QD 3.500 . 3.500 1.780 1.520 2.116 . 0 0 "[ . 1 . 2]" 2
202 1 66 ARG QG 2 35 LEU QD 2.800 . 2.800 1.745 1.576 1.813 . 0 0 "[ . 1 . 2]" 2
203 1 6 CYS QB 2 35 LEU QD 5.000 . 5.000 3.227 2.888 3.517 . 0 0 "[ . 1 . 2]" 2
204 1 19 LEU HA 2 35 LEU QD 3.500 . 3.500 2.896 2.113 3.427 . 0 0 "[ . 1 . 2]" 2
205 1 2 GLN QE 2 35 LEU QD 5.000 . 5.000 4.131 3.041 4.819 . 0 0 "[ . 1 . 2]" 2
206 1 74 GLN QE 2 35 LEU QD 5.000 . 5.000 3.835 3.445 4.521 . 0 0 "[ . 1 . 2]" 2
207 1 32 TYR QD 2 35 LEU QD 5.000 . 5.000 3.493 2.832 3.835 . 0 0 "[ . 1 . 2]" 2
208 1 2 GLN QB 2 36 GLN QB 5.000 . 5.000 3.467 3.241 3.854 . 0 0 "[ . 1 . 2]" 2
209 1 4 ILE MD 2 36 GLN QB 5.000 . 5.000 3.665 2.676 4.519 . 0 0 "[ . 1 . 2]" 2
210 1 138 THR H 2 36 GLN QG 5.000 . 5.000 2.164 1.864 3.376 . 0 0 "[ . 1 . 2]" 2
211 1 135 LYS H 2 37 THR HB 3.500 . 3.500 3.901 3.784 4.153 0.653 19 1 "[ . 1 . +2]" 2
212 1 21 ILE QG 2 37 THR HB 5.000 . 5.000 4.917 4.314 5.079 0.079 17 0 "[ . 1 . 2]" 2
213 1 17 THR HA 2 37 THR MG 5.000 . 5.000 3.569 1.952 3.962 . 0 0 "[ . 1 . 2]" 2
214 1 25 THR H 2 37 THR MG 5.000 . 5.000 5.014 3.748 5.197 0.197 7 0 "[ . 1 . 2]" 2
215 1 43 THR HB 2 37 THR MG 5.000 . 5.000 4.575 3.396 5.012 0.012 14 0 "[ . 1 . 2]" 2
216 1 7 VAL QG 2 38 SER QB 5.000 . 5.000 4.867 4.631 4.930 . 0 0 "[ . 1 . 2]" 2
217 1 7 VAL QG 2 38 SER QB 5.000 . 5.000 4.868 4.632 4.930 . 0 0 "[ . 1 . 2]" 2
218 1 43 THR HB 2 39 ASN QB 5.000 . 5.000 4.429 3.888 4.996 . 0 0 "[ . 1 . 2]" 2
219 1 43 THR HB 2 39 ASN QB 5.000 . 5.000 4.429 3.888 4.996 . 0 0 "[ . 1 . 2]" 2
220 1 2 GLN HA 2 39 ASN QB 5.000 . 5.000 4.277 2.810 4.830 . 0 0 "[ . 1 . 2]" 2
221 1 2 GLN HA 2 39 ASN QB 5.000 . 5.000 4.277 2.810 4.830 . 0 0 "[ . 1 . 2]" 2
222 1 36 VAL H 2 40 ILE HA 5.000 . 5.000 4.415 3.854 4.919 . 0 0 "[ . 1 . 2]" 2
223 1 20 LEU HG 2 40 ILE MD 5.000 . 5.000 4.129 3.067 4.912 . 0 0 "[ . 1 . 2]" 2
224 1 39 ASN QB 2 40 ILE MD 5.000 . 5.000 3.775 1.952 5.020 0.020 9 0 "[ . 1 . 2]" 2
225 1 25 THR HB 2 40 ILE MD 5.000 . 5.000 5.030 4.847 5.113 0.113 14 0 "[ . 1 . 2]" 2
226 1 11 ASP QB 2 40 ILE MD 5.000 . 5.000 3.969 3.171 5.101 0.101 6 0 "[ . 1 . 2]" 2
227 1 1 MET HA 2 40 ILE QG 5.000 . 5.000 4.850 4.525 5.010 0.010 8 0 "[ . 1 . 2]" 2
228 1 25 THR HB 2 40 ILE MG 5.000 . 5.000 3.998 2.722 5.167 0.167 6 0 "[ . 1 . 2]" 2
229 1 36 VAL H 2 40 ILE MG 5.000 . 5.000 3.648 2.506 4.758 . 0 0 "[ . 1 . 2]" 2
230 1 36 VAL H 2 41 THR MG 5.000 . 5.000 3.455 2.627 4.175 . 0 0 "[ . 1 . 2]" 2
231 1 36 VAL H 2 44 GLU HA 3.500 . 3.500 2.599 2.129 3.516 0.016 19 0 "[ . 1 . 2]" 2
232 1 26 ASN QB 1 33 VAL QG 5.000 . 5.000 5.074 5.000 5.189 0.189 13 0 "[ . 1 . 2]" 2
233 1 1 MET ME 1 125 THR MG 5.000 . 5.000 3.597 2.617 4.179 . 0 0 "[ . 1 . 2]" 2
234 1 1 MET QG 1 17 THR MG 5.000 . 5.000 3.146 1.879 4.180 . 0 0 "[ . 1 . 2]" 2
235 1 1 MET QB 1 80 VAL QG 3.500 . 3.500 2.329 1.789 3.017 . 0 0 "[ . 1 . 2]" 2
236 1 4 ILE MD 1 17 THR MG 2.800 . 2.800 1.970 1.645 2.553 . 0 0 "[ . 1 . 2]" 2
237 1 4 ILE HB 1 17 THR MG 5.000 . 5.000 4.147 3.165 4.674 . 0 0 "[ . 1 . 2]" 2
238 1 4 ILE HB 1 80 VAL QG 5.000 . 5.000 3.021 2.079 4.019 . 0 0 "[ . 1 . 2]" 2
239 1 7 VAL QG 1 80 VAL QG 3.500 . 3.500 1.972 1.595 2.481 . 0 0 "[ . 1 . 2]" 2
240 1 4 ILE MD 1 36 VAL QG 3.500 . 3.500 2.213 1.632 3.345 . 0 0 "[ . 1 . 2]" 2
241 1 2 GLN QE 1 36 VAL QG 5.000 . 5.000 2.267 1.927 2.672 . 0 0 "[ . 1 . 2]" 2
242 1 32 TYR QD 1 36 VAL QG 3.500 . 3.500 2.504 1.688 2.933 . 0 0 "[ . 1 . 2]" 2
243 1 27 LYS QD 1 36 VAL QG 5.000 . 5.000 2.161 1.783 3.663 . 0 0 "[ . 1 . 2]" 2
244 1 33 VAL QG 1 36 VAL QG 3.500 . 3.500 2.336 1.738 3.254 . 0 0 "[ . 1 . 2]" 2
245 1 12 GLY QA 1 36 VAL QG 3.500 . 3.500 2.112 1.683 2.916 . 0 0 "[ . 1 . 2]" 2
246 1 10 GLY H 1 36 VAL QG 5.000 . 5.000 2.049 1.695 2.830 . 0 0 "[ . 1 . 2]" 2
247 1 43 THR HB 1 44 VAL QG 5.000 . 5.000 2.968 1.982 3.777 . 0 0 "[ . 1 . 2]" 2
248 1 21 ILE HA 1 93 VAL QG 5.000 . 5.000 3.151 2.926 3.457 . 0 0 "[ . 1 . 2]" 2
249 1 8 VAL QG 1 68 ARG QD 5.000 . 5.000 3.293 1.771 3.680 . 0 0 "[ . 1 . 2]" 2
250 1 7 VAL QG 1 115 THR MG 3.500 . 3.500 3.250 2.097 3.572 0.072 18 0 "[ . 1 . 2]" 2
251 1 1 MET QG 1 115 THR MG 5.000 . 5.000 3.989 2.214 4.876 . 0 0 "[ . 1 . 2]" 2
252 1 8 VAL QG 1 26 ASN HA 5.000 . 5.000 4.538 3.557 4.947 . 0 0 "[ . 1 . 2]" 2
253 1 66 ARG QG 1 127 GLU HA 3.500 . 3.500 2.527 2.330 2.922 . 0 0 "[ . 1 . 2]" 2
254 1 1 MET ME 1 21 ILE QG 5.000 . 5.000 4.457 3.682 4.839 . 0 0 "[ . 1 . 2]" 2
255 1 10 GLY QA 1 21 ILE QG 5.000 . 5.000 3.831 1.685 4.159 . 0 0 "[ . 1 . 2]" 2
256 1 17 THR HA 1 21 ILE QG 5.000 . 5.000 1.973 1.781 2.866 . 0 0 "[ . 1 . 2]" 2
257 1 20 LEU H 1 21 ILE QG 5.000 . 5.000 3.652 3.338 3.985 . 0 0 "[ . 1 . 2]" 2
258 1 3 THR MG 1 19 LEU QD 3.500 . 3.500 2.027 1.497 2.931 . 0 0 "[ . 1 . 2]" 2
259 1 9 VAL HB 1 19 LEU QD 3.500 . 3.500 3.489 3.316 3.609 0.109 20 0 "[ . 1 . 2]" 2
260 1 4 ILE QG 1 19 LEU QD 3.500 . 3.500 2.388 1.659 3.320 . 0 0 "[ . 1 . 2]" 2
261 1 19 LEU H 1 98 VAL HB 3.500 . 3.500 4.622 4.430 6.163 2.663 18 20 [*************-***+**] 2
262 1 9 VAL QG 1 62 GLU QG 5.000 . 5.000 3.627 2.467 4.440 . 0 0 "[ . 1 . 2]" 2
263 1 7 VAL QG 1 107 LYS QE 5.000 . 5.000 4.573 3.842 4.908 . 0 0 "[ . 1 . 2]" 2
264 1 66 ARG QD 1 67 LEU QB 5.000 . 5.000 4.238 3.764 4.869 . 0 0 "[ . 1 . 2]" 2
265 1 8 VAL HB 1 179 PRO QD 3.500 . 3.500 2.642 2.398 2.710 . 0 0 "[ . 1 . 2]" 2
266 1 1 MET ME 1 129 LEU HA 5.000 . 5.000 3.410 2.934 3.769 . 0 0 "[ . 1 . 2]" 2
267 1 4 ILE HB 1 4 ILE MD 3.500 . 3.500 2.294 2.001 3.200 . 0 0 "[ . 1 . 2]" 2
268 1 7 VAL QG 1 8 VAL H 5.000 . 5.000 2.137 1.833 2.966 . 0 0 "[ . 1 . 2]" 2
269 1 4 ILE QG 1 13 ALA MB 5.000 . 5.000 4.646 3.766 5.013 0.013 15 0 "[ . 1 . 2]" 2
270 1 10 GLY QA 1 13 ALA MB 5.000 . 5.000 4.742 3.476 5.174 0.174 4 0 "[ . 1 . 2]" 2
271 1 13 ALA MB 2 6 PRO QD 5.000 . 5.000 12.766 11.575 13.827 8.827 13 20 [************+******-] 2
272 1 19 LEU QD 1 24 THR H 5.000 . 5.000 4.415 3.695 4.945 . 0 0 "[ . 1 . 2]" 2
273 1 7 VAL QG 1 19 LEU QD 3.500 . 3.500 3.391 3.012 3.497 . 0 0 "[ . 1 . 2]" 2
274 1 19 LEU QD 1 20 LEU HG 5.000 . 5.000 3.679 2.283 4.960 . 0 0 "[ . 1 . 2]" 2
275 1 19 LEU QD 1 34 PRO QB 5.000 . 5.000 6.786 5.966 7.446 2.446 14 20 [-************+******] 2
276 1 19 LEU QD 1 23 TYR QD 3.500 . 3.500 2.228 1.729 2.630 . 0 0 "[ . 1 . 2]" 2
277 1 19 LEU HG 1 23 TYR QD 5.000 . 5.000 3.506 2.282 4.955 . 0 0 "[ . 1 . 2]" 2
278 1 20 LEU H 1 21 ILE MD 5.000 . 5.000 3.773 3.271 4.041 . 0 0 "[ . 1 . 2]" 2
279 1 17 THR MG 1 21 ILE MD 3.500 . 3.500 3.059 1.844 3.726 0.226 16 0 "[ . 1 . 2]" 2
280 1 10 GLY QA 1 21 ILE MG 5.000 . 5.000 4.990 4.607 5.269 0.269 19 0 "[ . 1 . 2]" 2
281 1 20 LEU H 1 21 ILE MG 5.000 . 5.000 3.913 3.634 4.164 . 0 0 "[ . 1 . 2]" 2
282 1 10 GLY H 1 23 TYR HA 5.000 . 5.000 4.482 3.995 4.974 . 0 0 "[ . 1 . 2]" 2
283 1 10 GLY H 1 24 THR HB 5.000 . 5.000 3.425 2.668 4.396 . 0 0 "[ . 1 . 2]" 2
284 1 10 GLY H 1 24 THR MG 5.000 . 5.000 2.788 1.841 3.556 . 0 0 "[ . 1 . 2]" 2
285 1 10 GLY QA 1 25 THR HB 5.000 . 5.000 5.137 5.038 5.237 0.237 10 0 "[ . 1 . 2]" 2
286 1 21 ILE MG 1 25 THR MG 5.000 . 5.000 3.453 2.518 4.473 . 0 0 "[ . 1 . 2]" 2
287 1 10 GLY QA 1 25 THR MG 5.000 . 5.000 4.720 4.273 5.304 0.304 19 0 "[ . 1 . 2]" 2
288 1 3 THR MG 1 25 THR MG 5.000 . 5.000 2.322 1.674 3.714 . 0 0 "[ . 1 . 2]" 2
289 1 2 GLN QE 1 25 THR MG 5.000 . 5.000 3.146 1.900 4.244 . 0 0 "[ . 1 . 2]" 2
290 1 27 LYS HA 1 27 LYS QD 5.000 . 5.000 4.029 3.506 4.288 . 0 0 "[ . 1 . 2]" 2
291 1 7 VAL QG 1 31 GLU QB 5.000 . 5.000 2.716 2.272 3.647 . 0 0 "[ . 1 . 2]" 2
292 1 31 GLU QG 1 33 VAL QG 3.500 . 3.500 3.091 2.187 3.553 0.053 9 0 "[ . 1 . 2]" 2
293 1 8 VAL QG 1 36 VAL QG 5.000 . 5.000 1.931 1.645 2.182 . 0 0 "[ . 1 . 2]" 2
294 1 32 TYR QE 1 40 TYR QD 5.000 . 5.000 2.237 1.909 2.755 . 0 0 "[ . 1 . 2]" 2
295 1 8 VAL QG 1 40 TYR QD 5.000 . 5.000 2.452 1.971 3.511 . 0 0 "[ . 1 . 2]" 2
296 1 1 MET QB 1 41 ALA MB 5.000 . 5.000 2.392 1.842 4.233 . 0 0 "[ . 1 . 2]" 2
297 1 1 MET ME 1 42 VAL QG 5.000 . 5.000 2.451 1.774 4.089 . 0 0 "[ . 1 . 2]" 2
298 1 3 THR MG 1 42 VAL QG 5.000 . 5.000 2.430 1.774 4.115 . 0 0 "[ . 1 . 2]" 2
299 1 6 CYS HA 1 42 VAL QG 5.000 . 5.000 3.261 3.114 3.410 . 0 0 "[ . 1 . 2]" 2
300 1 27 LYS QD 1 42 VAL QG 5.000 . 5.000 2.026 1.757 2.623 . 0 0 "[ . 1 . 2]" 2
301 1 42 VAL QG 1 65 ASP QB 5.000 . 5.000 3.137 2.390 3.968 . 0 0 "[ . 1 . 2]" 2
302 1 24 THR HB 1 42 VAL QG 5.000 . 5.000 2.684 1.832 3.287 . 0 0 "[ . 1 . 2]" 2
303 1 1 MET QB 1 43 THR MG 5.000 . 5.000 4.398 4.052 4.793 . 0 0 "[ . 1 . 2]" 2
304 1 1 MET QG 1 43 THR MG 5.000 . 5.000 3.107 2.537 4.187 . 0 0 "[ . 1 . 2]" 2
305 1 4 ILE QG 1 44 VAL HB 5.000 . 5.000 3.854 2.986 4.501 . 0 0 "[ . 1 . 2]" 2
306 1 44 VAL QG 1 46 ILE QG 5.000 . 5.000 1.978 1.761 2.447 . 0 0 "[ . 1 . 2]" 2
307 1 5 LYS HA 1 44 VAL QG 5.000 . 5.000 3.264 2.869 3.599 . 0 0 "[ . 1 . 2]" 2
308 1 3 THR MG 1 44 VAL QG 5.000 . 5.000 3.641 3.347 3.988 . 0 0 "[ . 1 . 2]" 2
309 1 1 MET ME 1 44 VAL QG 5.000 . 5.000 2.799 1.856 3.779 . 0 0 "[ . 1 . 2]" 2
310 1 5 LYS HA 1 44 VAL QG 3.500 . 3.500 3.263 2.869 3.598 0.098 12 0 "[ . 1 . 2]" 2
311 1 5 LYS HA 1 45 MET ME 5.000 . 5.000 4.855 4.380 5.006 0.006 19 0 "[ . 1 . 2]" 2
312 1 29 PRO HA 1 45 MET ME 5.000 . 5.000 4.563 3.455 5.025 0.025 4 0 "[ . 1 . 2]" 2
313 1 4 ILE MD 1 46 ILE MD 3.500 . 3.500 1.924 1.617 2.472 . 0 0 "[ . 1 . 2]" 2
314 1 7 VAL QG 1 46 ILE MD 3.500 . 3.500 2.118 1.723 2.636 . 0 0 "[ . 1 . 2]" 2
315 1 46 ILE MG 1 66 ARG QG 5.000 . 5.000 3.777 2.012 4.864 . 0 0 "[ . 1 . 2]" 2
316 1 20 LEU HG 1 51 TYR QE 5.000 . 5.000 3.859 2.472 4.994 . 0 0 "[ . 1 . 2]" 2
317 1 2 GLN QB 1 53 LEU QD 5.000 . 5.000 2.962 2.032 3.911 . 0 0 "[ . 1 . 2]" 2
318 1 34 PRO QB 1 53 LEU QD 5.000 . 5.000 3.769 2.809 4.541 . 0 0 "[ . 1 . 2]" 2
319 1 53 LEU H 1 53 LEU QD 5.000 . 5.000 2.243 1.788 2.886 . 0 0 "[ . 1 . 2]" 2
320 1 20 LEU HG 1 55 LEU QD 5.000 . 5.000 2.292 1.848 3.795 . 0 0 "[ . 1 . 2]" 2
321 1 28 PHE QE 1 55 LEU QD 5.000 . 5.000 3.119 1.905 4.350 . 0 0 "[ . 1 . 2]" 2
322 1 37 PHE H 1 56 PHE QD 5.000 . 5.000 3.556 2.604 4.681 . 0 0 "[ . 1 . 2]" 2
323 1 24 THR HB 1 58 THR MG 5.000 . 5.000 3.996 2.850 4.958 . 0 0 "[ . 1 . 2]" 2
324 1 4 ILE QG 1 59 ALA MB 5.000 . 5.000 2.784 1.694 4.022 . 0 0 "[ . 1 . 2]" 2
325 1 59 ALA MB 1 64 TYR QB 5.000 . 5.000 4.449 2.994 4.895 . 0 0 "[ . 1 . 2]" 2
326 1 55 LEU QB 1 59 ALA MB 5.000 . 5.000 3.791 2.613 4.921 . 0 0 "[ . 1 . 2]" 2
327 1 27 LYS H 1 59 ALA MB 5.000 . 5.000 3.234 2.153 4.555 . 0 0 "[ . 1 . 2]" 2
328 1 12 GLY QA 1 59 ALA MB 5.000 . 5.000 3.372 2.264 4.917 . 0 0 "[ . 1 . 2]" 2
329 1 33 VAL H 1 61 LEU QD 5.000 . 5.000 3.994 2.514 5.036 0.036 14 0 "[ . 1 . 2]" 2
330 1 4 ILE QG 1 64 TYR QD 5.000 . 5.000 3.830 2.504 4.778 . 0 0 "[ . 1 . 2]" 2
331 1 31 GLU QB 1 64 TYR QD 5.000 . 5.000 3.079 2.145 4.240 . 0 0 "[ . 1 . 2]" 2
332 1 32 TYR QD 1 64 TYR QE 5.000 . 5.000 3.546 2.513 4.432 . 0 0 "[ . 1 . 2]" 2
333 1 31 GLU QB 1 64 TYR QE 5.000 . 5.000 2.345 1.778 4.061 . 0 0 "[ . 1 . 2]" 2
334 1 8 VAL QG 1 67 LEU QD 5.000 . 5.000 3.047 2.558 3.302 . 0 0 "[ . 1 . 2]" 2
335 1 32 TYR QD 1 67 LEU QD 3.500 . 3.500 1.725 1.516 1.907 . 0 0 "[ . 1 . 2]" 2
336 1 8 VAL QG 1 67 LEU QD 5.000 . 5.000 3.047 2.558 3.303 . 0 0 "[ . 1 . 2]" 2
337 1 12 GLY QA 1 67 LEU QD 5.000 . 5.000 3.443 2.943 3.777 . 0 0 "[ . 1 . 2]" 2
338 1 32 TYR QD 1 67 LEU QD 3.500 . 3.500 1.827 1.703 2.228 . 0 0 "[ . 1 . 2]" 2
339 1 34 PRO QB 1 67 LEU QD 5.000 . 5.000 6.745 6.192 7.122 2.122 12 20 [***********+******-*] 2
340 1 4 ILE QG 1 70 LEU QD 5.000 . 5.000 3.192 2.748 3.587 . 0 0 "[ . 1 . 2]" 2
341 1 37 PHE H 1 70 LEU QD 5.000 . 5.000 2.905 1.812 3.270 . 0 0 "[ . 1 . 2]" 2
342 1 7 VAL QG 1 72 TYR QE 5.000 . 5.000 4.890 4.141 5.259 0.259 14 0 "[ . 1 . 2]" 2
343 1 32 TYR QE 1 75 THR MG 5.000 . 5.000 4.434 3.314 5.019 0.019 15 0 "[ . 1 . 2]" 2
344 1 3 THR MG 1 77 VAL QG 5.000 . 5.000 4.670 4.061 4.949 . 0 0 "[ . 1 . 2]" 2
345 1 46 ILE QG 1 77 VAL QG 3.500 . 3.500 2.306 1.726 2.610 . 0 0 "[ . 1 . 2]" 2
346 1 77 VAL QG 1 93 VAL H 5.000 . 5.000 4.646 3.893 5.024 0.024 16 0 "[ . 1 . 2]" 2
347 1 46 ILE QG 1 77 VAL QG 3.500 . 3.500 2.406 1.732 3.022 . 0 0 "[ . 1 . 2]" 2
348 1 20 LEU QD 1 78 PHE QD 5.000 . 5.000 4.681 4.204 4.936 . 0 0 "[ . 1 . 2]" 2
349 1 17 THR MG 1 80 VAL HB 5.000 . 5.000 2.610 1.780 3.891 . 0 0 "[ . 1 . 2]" 2
350 1 32 TYR QE 1 80 VAL QG 5.000 . 5.000 2.855 1.829 3.631 . 0 0 "[ . 1 . 2]" 2
351 1 7 VAL QG 1 82 PHE QD 5.000 . 5.000 2.480 1.737 3.594 . 0 0 "[ . 1 . 2]" 2
352 1 4 ILE QG 1 84 VAL QG 5.000 . 5.000 3.581 2.062 4.700 . 0 0 "[ . 1 . 2]" 2
353 1 24 THR HB 1 84 VAL QG 5.000 . 5.000 3.746 3.130 4.886 . 0 0 "[ . 1 . 2]" 2
354 1 69 PRO QD 1 84 VAL QG 5.000 . 5.000 2.603 1.784 4.303 . 0 0 "[ . 1 . 2]" 2
355 1 8 VAL HA 1 85 VAL QG 5.000 . 5.000 3.748 2.932 5.006 0.006 15 0 "[ . 1 . 2]" 2
356 1 31 GLU QB 1 85 VAL QG 5.000 . 5.000 3.740 1.770 4.704 . 0 0 "[ . 1 . 2]" 2
357 1 1 MET ME 1 85 VAL QG 5.000 . 5.000 2.604 1.839 3.709 . 0 0 "[ . 1 . 2]" 2
358 1 33 VAL QG 1 85 VAL QG 3.500 . 3.500 2.151 1.656 2.826 . 0 0 "[ . 1 . 2]" 2
359 1 7 VAL QG 1 85 VAL QG 3.500 . 3.500 2.274 1.726 3.150 . 0 0 "[ . 1 . 2]" 2
360 1 37 PHE H 1 93 VAL QG 5.000 . 5.000 2.891 2.093 3.998 . 0 0 "[ . 1 . 2]" 2
361 1 33 VAL QG 1 101 ILE MD 3.500 . 3.500 2.403 1.521 3.418 . 0 0 "[ . 1 . 2]" 2
362 1 7 VAL QG 1 101 ILE MD 5.000 . 5.000 3.205 2.494 3.887 . 0 0 "[ . 1 . 2]" 2
363 1 33 VAL QG 1 101 ILE MG 5.000 . 5.000 3.504 1.780 4.624 . 0 0 "[ . 1 . 2]" 2
364 1 9 VAL QG 1 101 ILE MG 3.500 . 3.500 2.532 1.775 3.363 . 0 0 "[ . 1 . 2]" 2
365 1 3 THR MG 1 101 ILE MG 5.000 . 5.000 3.425 1.788 4.678 . 0 0 "[ . 1 . 2]" 2
366 1 4 ILE MD 1 110 PHE QD 5.000 . 5.000 3.342 1.891 4.030 . 0 0 "[ . 1 . 2]" 2
367 1 23 TYR QD 1 110 PHE QD 5.000 . 5.000 4.858 3.807 5.120 0.120 13 0 "[ . 1 . 2]" 2
368 1 8 VAL QG 1 111 LEU QD 3.500 . 3.500 2.056 1.596 3.106 . 0 0 "[ . 1 . 2]" 2
369 1 2 GLN QB 1 111 LEU QD 3.500 . 3.500 2.890 2.199 3.245 . 0 0 "[ . 1 . 2]" 2
370 1 38 ASP H 1 111 LEU QD 5.000 . 5.000 4.779 4.264 5.013 0.013 18 0 "[ . 1 . 2]" 2
371 1 83 SER H 1 111 LEU QD 3.500 . 3.500 2.950 2.298 3.477 . 0 0 "[ . 1 . 2]" 2
372 1 8 VAL HB 1 112 LEU QD 5.000 . 5.000 2.584 1.779 3.742 . 0 0 "[ . 1 . 2]" 2
373 1 24 THR HB 1 112 LEU QD 5.000 . 5.000 4.859 4.266 4.985 . 0 0 "[ . 1 . 2]" 2
374 1 51 TYR QD 1 112 LEU QD 5.000 . 5.000 4.071 2.775 4.924 . 0 0 "[ . 1 . 2]" 2
375 1 4 ILE MD 1 112 LEU QD 3.500 . 3.500 2.308 1.757 3.044 . 0 0 "[ . 1 . 2]" 2
376 1 7 VAL QG 1 112 LEU QD 3.500 . 3.500 1.946 1.502 2.597 . 0 0 "[ . 1 . 2]" 2
377 1 10 GLY H 1 112 LEU QD 5.000 . 5.000 7.376 6.509 7.955 2.955 2 20 [*+*****-************] 2
378 1 7 VAL QG 1 113 VAL QG 5.000 . 5.000 3.827 3.327 4.203 . 0 0 "[ . 1 . 2]" 2
379 1 4 ILE MD 1 113 VAL QG 3.500 . 3.500 2.494 1.795 3.184 . 0 0 "[ . 1 . 2]" 2
380 1 7 VAL QG 1 113 VAL QG 3.500 . 3.500 2.232 1.635 3.098 . 0 0 "[ . 1 . 2]" 2
381 1 32 TYR H 1 113 VAL QG 5.000 . 5.000 2.579 1.854 3.227 . 0 0 "[ . 1 . 2]" 2
382 1 4 ILE QG 1 113 VAL QG 5.000 . 5.000 3.592 3.305 3.946 . 0 0 "[ . 1 . 2]" 2
383 1 46 ILE QG 1 113 VAL QG 5.000 . 5.000 4.586 3.763 4.933 . 0 0 "[ . 1 . 2]" 2
384 1 40 TYR H 1 117 ILE MD 5.000 . 5.000 4.101 3.926 4.363 . 0 0 "[ . 1 . 2]" 2
385 1 4 ILE QG 1 117 ILE MD 3.500 . 3.500 3.286 2.980 3.528 0.028 9 0 "[ . 1 . 2]" 2
386 1 93 VAL H 1 117 ILE MD 5.000 . 5.000 4.915 3.542 5.104 0.104 12 0 "[ . 1 . 2]" 2
387 1 11 ASP QB 1 119 LEU QD 5.000 . 5.000 3.593 2.448 4.473 . 0 0 "[ . 1 . 2]" 2
388 1 1 MET ME 1 124 SER QB 5.000 . 5.000 3.730 3.200 4.331 . 0 0 "[ . 1 . 2]" 2
389 1 1 MET ME 1 125 THR HB 5.000 . 5.000 4.694 4.200 5.023 0.023 13 0 "[ . 1 . 2]" 2
390 1 110 PHE HZ 1 126 ILE MD 5.000 . 5.000 3.742 2.383 4.900 . 0 0 "[ . 1 . 2]" 2
391 1 13 ALA HA 1 126 ILE MD 3.500 . 3.500 3.299 1.918 3.490 . 0 0 "[ . 1 . 2]" 2
392 1 114 GLY QA 1 126 ILE MG 5.000 . 5.000 4.628 3.115 5.045 0.045 13 0 "[ . 1 . 2]" 2
393 1 61 LEU QB 1 126 ILE MG 3.500 . 3.500 3.513 3.483 3.576 0.076 2 0 "[ . 1 . 2]" 2
394 1 3 THR H 1 126 ILE MG 3.500 . 3.500 3.207 3.107 3.268 . 0 0 "[ . 1 . 2]" 2
395 1 17 THR HA 1 126 ILE MG 3.500 . 3.500 3.446 3.374 3.494 . 0 0 "[ . 1 . 2]" 2
396 1 1 MET QB 1 129 LEU QD 3.500 . 3.500 2.426 1.678 3.205 . 0 0 "[ . 1 . 2]" 2
397 1 17 THR HB 1 129 LEU QD 5.000 . 5.000 2.093 1.720 4.068 . 0 0 "[ . 1 . 2]" 2
398 1 7 VAL QG 1 129 LEU QD 3.500 . 3.500 2.138 1.611 2.742 . 0 0 "[ . 1 . 2]" 2
399 1 4 ILE HB 1 129 LEU QD 5.000 . 5.000 4.092 3.054 4.699 . 0 0 "[ . 1 . 2]" 2
400 1 1 MET ME 1 129 LEU QD 5.000 . 5.000 2.294 1.677 3.081 . 0 0 "[ . 1 . 2]" 2
401 1 39 ASN H 1 130 ALA HA 3.500 . 3.500 2.841 2.469 3.201 . 0 0 "[ . 1 . 2]" 2
402 1 9 VAL HB 1 130 ALA MB 5.000 . 5.000 4.081 3.739 4.345 . 0 0 "[ . 1 . 2]" 2
403 1 1 MET ME 1 130 ALA MB 5.000 . 5.000 3.631 3.036 3.946 . 0 0 "[ . 1 . 2]" 2
404 1 1 MET QB 1 132 ASN QB 5.000 . 5.000 3.290 2.297 3.770 . 0 0 "[ . 1 . 2]" 2
405 1 1 MET ME 1 137 ILE MD 5.000 . 5.000 3.352 2.406 4.197 . 0 0 "[ . 1 . 2]" 2
406 1 2 GLN QE 1 137 ILE MD 5.000 . 5.000 2.740 2.330 3.835 . 0 0 "[ . 1 . 2]" 2
407 1 43 THR HB 1 137 ILE MD 3.500 . 3.500 3.299 2.195 3.574 0.074 12 0 "[ . 1 . 2]" 2
408 1 24 THR H 1 137 ILE MG 5.000 . 5.000 3.095 2.662 3.798 . 0 0 "[ . 1 . 2]" 2
409 1 2 GLN QE 1 137 ILE MG 5.000 . 5.000 2.514 1.969 3.336 . 0 0 "[ . 1 . 2]" 2
410 1 43 THR HB 1 138 THR MG 3.500 . 3.500 3.363 3.236 3.522 0.022 9 0 "[ . 1 . 2]" 2
411 1 34 PRO QB 1 139 PRO HA 5.000 . 5.000 5.036 4.830 5.123 0.123 11 0 "[ . 1 . 2]" 2
412 1 2 GLN QE 1 141 THR MG 3.500 . 3.500 3.115 2.347 3.524 0.024 14 0 "[ . 1 . 2]" 2
413 1 24 THR H 1 141 THR MG 3.500 . 3.500 3.151 3.022 3.284 . 0 0 "[ . 1 . 2]" 2
414 1 32 TYR QE 1 143 GLU QG 5.000 . 5.000 4.296 1.884 4.983 . 0 0 "[ . 1 . 2]" 2
415 1 45 MET ME 1 145 LEU QD 3.500 . 3.500 3.132 2.629 3.429 . 0 0 "[ . 1 . 2]" 2
416 1 25 THR HB 1 145 LEU QD 5.000 . 5.000 3.523 3.129 3.966 . 0 0 "[ . 1 . 2]" 2
417 1 55 LEU QB 1 145 LEU QD 3.500 . 3.500 2.354 1.753 3.197 . 0 0 "[ . 1 . 2]" 2
418 1 7 VAL QG 1 145 LEU QD 5.000 . 5.000 4.176 3.443 4.594 . 0 0 "[ . 1 . 2]" 2
419 1 23 TYR QD 1 145 LEU QD 5.000 . 5.000 2.493 1.714 3.257 . 0 0 "[ . 1 . 2]" 2
420 1 20 LEU QD 1 146 ALA HA 5.000 . 5.000 2.949 2.178 3.660 . 0 0 "[ . 1 . 2]" 2
421 1 71 SER H 1 146 ALA MB 5.000 . 5.000 3.994 3.844 4.197 . 0 0 "[ . 1 . 2]" 2
422 1 7 VAL QG 1 146 ALA MB 5.000 . 5.000 2.784 1.853 3.266 . 0 0 "[ . 1 . 2]" 2
423 1 32 TYR QE 1 146 ALA MB 5.000 . 5.000 9.987 9.353 11.047 6.047 3 20 [**+********-********] 2
424 1 4 ILE MD 1 146 ALA MB 5.000 . 5.000 4.543 4.198 4.932 . 0 0 "[ . 1 . 2]" 2
425 1 21 ILE QG 1 151 ALA MB 3.500 . 3.500 3.078 2.714 3.429 . 0 0 "[ . 1 . 2]" 2
426 1 32 TYR QE 1 151 ALA MB 3.500 . 3.500 2.677 2.200 3.416 . 0 0 "[ . 1 . 2]" 2
427 1 8 VAL QG 1 152 VAL HB 3.500 . 3.500 3.563 3.482 3.648 0.148 14 0 "[ . 1 . 2]" 2
428 1 1 MET ME 1 152 VAL QG 5.000 . 5.000 3.738 2.398 4.167 . 0 0 "[ . 1 . 2]" 2
429 1 7 VAL QG 1 152 VAL QG 3.500 . 3.500 3.185 1.935 3.602 0.102 17 0 "[ . 1 . 2]" 2
430 1 4 ILE MD 1 153 LYS QB 5.000 . 5.000 3.864 3.179 4.147 . 0 0 "[ . 1 . 2]" 2
431 1 11 ASP QB 1 153 LYS QG 5.000 . 5.000 4.690 4.362 4.939 . 0 0 "[ . 1 . 2]" 2
432 1 4 ILE MD 1 153 LYS QG 5.000 . 5.000 3.408 2.041 4.152 . 0 0 "[ . 1 . 2]" 2
433 1 138 THR H 1 155 VAL QG 5.000 . 5.000 4.010 3.552 4.642 . 0 0 "[ . 1 . 2]" 2
434 1 120 ARG H 1 155 VAL QG 5.000 . 5.000 3.396 2.046 4.776 . 0 0 "[ . 1 . 2]" 2
435 1 17 THR MG 1 159 ALA HA 5.000 . 5.000 4.435 4.185 4.748 . 0 0 "[ . 1 . 2]" 2
436 1 10 GLY QA 1 159 ALA MB 5.000 . 5.000 3.897 3.230 4.337 . 0 0 "[ . 1 . 2]" 2
437 1 25 THR H 1 160 LEU QD 5.000 . 5.000 4.879 3.283 5.134 0.134 11 0 "[ . 1 . 2]" 2
438 1 21 ILE MG 1 161 THR MG 3.500 . 3.500 2.661 1.801 3.433 . 0 0 "[ . 1 . 2]" 2
439 1 10 GLY QA 1 165 LEU QD 5.000 . 5.000 4.194 2.559 4.505 . 0 0 "[ . 1 . 2]" 2
440 1 23 TYR QD 1 165 LEU QD 5.000 . 5.000 2.057 1.791 2.427 . 0 0 "[ . 1 . 2]" 2
441 1 4 ILE MD 1 167 ASN HA 5.000 . 5.000 4.419 3.682 4.921 . 0 0 "[ . 1 . 2]" 2
442 1 8 VAL QG 1 167 ASN HA 5.000 . 5.000 4.841 4.516 4.977 . 0 0 "[ . 1 . 2]" 2
443 1 46 ILE QG 1 168 VAL QG 5.000 . 5.000 2.766 2.264 3.232 . 0 0 "[ . 1 . 2]" 2
444 1 3 THR MG 1 172 ALA MB 5.000 . 5.000 4.832 4.238 5.075 0.075 12 0 "[ . 1 . 2]" 2
445 1 8 VAL QG 1 172 ALA MB 3.500 . 3.500 2.808 1.912 3.167 . 0 0 "[ . 1 . 2]" 2
446 1 29 PRO HA 1 173 ILE MD 5.000 . 5.000 4.161 2.357 5.003 0.003 6 0 "[ . 1 . 2]" 2
447 1 8 VAL QG 1 175 ALA MB 3.500 . 3.500 2.525 1.734 3.117 . 0 0 "[ . 1 . 2]" 2
448 1 2 GLN QB 1 175 ALA MB 5.000 . 5.000 3.358 3.128 3.613 . 0 0 "[ . 1 . 2]" 2
449 1 8 VAL HB 1 175 ALA MB 5.000 . 5.000 4.065 3.157 4.811 . 0 0 "[ . 1 . 2]" 2
450 1 4 ILE MD 1 176 ALA HA 5.000 . 5.000 3.340 2.774 3.857 . 0 0 "[ . 1 . 2]" 2
451 1 4 ILE MD 1 176 ALA MB 3.500 . 3.500 1.797 1.538 2.322 . 0 0 "[ . 1 . 2]" 2
452 1 8 VAL HB 1 179 PRO QD 5.000 . 5.000 3.539 2.661 4.190 . 0 0 "[ . 1 . 2]" 2
453 1 2 GLN HA 1 89 SER H 3.500 . 3.500 2.994 2.883 3.110 . 0 0 "[ . 1 . 2]" 2
454 1 4 ILE QG 1 84 VAL H 3.500 . 3.500 2.270 1.834 2.909 . 0 0 "[ . 1 . 2]" 2
455 1 4 ILE QG 1 40 TYR H 5.000 . 5.000 3.720 2.674 4.323 . 0 0 "[ . 1 . 2]" 2
456 1 32 TYR QE 1 40 TYR H 5.000 . 5.000 5.010 4.634 5.167 0.167 4 0 "[ . 1 . 2]" 2
457 1 28 PHE HA 1 46 ILE H 5.000 . 5.000 4.667 4.125 4.981 . 0 0 "[ . 1 . 2]" 2
458 1 5 LYS H 1 8 VAL H 5.000 . 5.000 5.032 4.960 5.120 0.120 5 0 "[ . 1 . 2]" 2
459 1 7 VAL H 1 8 VAL QG 5.000 . 5.000 4.061 3.777 4.431 . 0 0 "[ . 1 . 2]" 2
460 1 2 GLN QG 1 9 VAL H 5.000 . 5.000 6.974 6.281 7.549 2.549 14 20 [*****-*******+******] 2
461 1 4 ILE QG 1 9 VAL H 5.000 . 5.000 4.427 4.233 4.614 . 0 0 "[ . 1 . 2]" 2
462 1 10 GLY H 1 11 ASP HA 5.000 . 5.000 4.721 4.204 5.034 0.034 11 0 "[ . 1 . 2]" 2
463 1 10 GLY H 1 46 ILE QG 5.000 . 5.000 8.776 7.766 9.849 4.849 13 20 [*******-****+*******] 2
464 1 7 VAL QG 1 16 LYS H 5.000 . 5.000 5.098 4.937 5.290 0.290 16 0 "[ . 1 . 2]" 2
465 1 16 LYS H 1 27 LYS QB 5.000 . 5.000 4.699 3.911 4.967 . 0 0 "[ . 1 . 2]" 2
466 1 17 THR H 1 55 LEU QB 5.000 . 5.000 5.152 4.990 5.257 0.257 17 0 "[ . 1 . 2]" 2
467 1 17 THR H 1 45 MET QG 5.000 . 5.000 12.622 12.100 13.071 8.071 14 20 [*****-*******+******] 2
468 1 6 CYS H 1 17 THR H 5.000 . 5.000 7.622 6.171 8.412 3.412 10 20 [********-+**********] 2
469 1 2 GLN QB 1 18 CYS H 5.000 . 5.000 4.273 4.056 4.535 . 0 0 "[ . 1 . 2]" 2
470 1 1 MET QG 1 18 CYS H 5.000 . 5.000 5.246 5.001 5.720 0.720 16 3 "[ . -1 .+ *]" 2
471 1 11 ASP QB 1 18 CYS H 5.000 . 5.000 9.055 8.455 9.601 4.601 4 20 [***+********-*******] 2
472 1 12 GLY QA 1 18 CYS H 5.000 . 5.000 3.393 2.977 4.007 . 0 0 "[ . 1 . 2]" 2
473 1 12 GLY QA 1 19 LEU H 5.000 . 5.000 5.072 4.668 5.664 0.664 19 1 "[ . 1 . +2]" 2
474 1 19 LEU H 1 29 PRO HA 5.000 . 5.000 7.631 7.253 7.942 2.942 20 20 [*-*****************+] 2
475 1 20 LEU H 1 20 LEU HG 3.500 . 3.500 2.514 1.949 3.586 0.086 12 0 "[ . 1 . 2]" 2
476 1 3 THR HB 1 21 ILE H 5.000 . 5.000 4.996 4.714 5.071 0.071 16 0 "[ . 1 . 2]" 2
477 1 12 GLY QA 1 22 SER H 5.000 . 5.000 8.494 7.906 9.468 4.468 19 20 [***************-**+*] 2
478 1 10 GLY QA 1 25 THR H 5.000 . 5.000 3.629 2.868 4.349 . 0 0 "[ . 1 . 2]" 2
479 1 10 GLY QA 1 26 ASN H 5.000 . 5.000 4.970 4.813 5.132 0.132 13 0 "[ . 1 . 2]" 2
480 1 3 THR MG 1 26 ASN H 5.000 . 5.000 3.960 3.592 4.261 . 0 0 "[ . 1 . 2]" 2
481 1 10 GLY QA 1 27 LYS H 5.000 . 5.000 6.387 5.856 7.582 2.582 1 20 [+*************-*****] 2
482 1 21 ILE MG 1 27 LYS H 5.000 . 5.000 3.171 2.512 4.857 . 0 0 "[ . 1 . 2]" 2
483 1 17 THR HB 1 30 SER H 5.000 . 5.000 4.898 4.170 5.056 0.056 19 0 "[ . 1 . 2]" 2
484 1 30 SER H 1 138 THR H 5.000 . 5.000 9.880 9.087 10.690 5.690 11 20 [**********+*-*******] 2
485 1 31 GLU H 1 33 VAL QG 5.000 . 5.000 4.834 4.603 5.003 0.003 1 0 "[ . 1 . 2]" 2
486 1 31 GLU H 1 51 TYR QB 5.000 . 5.000 5.105 5.036 5.175 0.175 10 0 "[ . 1 . 2]" 2
487 1 29 PRO HA 1 31 GLU H 5.000 . 5.000 4.923 4.762 4.991 . 0 0 "[ . 1 . 2]" 2
488 1 29 PRO HA 1 32 TYR H 5.000 . 5.000 6.981 6.493 7.664 2.664 20 20 [******-************+] 2
489 1 25 THR H 1 35 THR H 5.000 . 5.000 9.187 8.823 9.949 4.949 20 20 [**********-********+] 2
490 1 32 TYR QE 1 35 THR H 5.000 . 5.000 5.060 5.012 5.145 0.145 10 0 "[ . 1 . 2]" 2
491 1 4 ILE QG 1 37 PHE H 5.000 . 5.000 2.688 2.244 2.977 . 0 0 "[ . 1 . 2]" 2
492 1 32 TYR QE 1 39 ASN H 5.000 . 5.000 3.280 1.978 4.483 . 0 0 "[ . 1 . 2]" 2
493 1 39 ASN QD 1 56 PHE QE 5.000 . 5.000 3.239 2.107 4.135 . 0 0 "[ . 1 . 2]" 2
494 1 32 TYR H 1 39 ASN QD 5.000 . 5.000 3.303 2.053 4.128 . 0 0 "[ . 1 . 2]" 2
495 1 4 ILE QG 1 41 ALA H 5.000 . 5.000 3.342 3.151 3.473 . 0 0 "[ . 1 . 2]" 2
496 1 1 MET QG 1 43 THR H 5.000 . 5.000 5.155 4.979 5.291 0.291 20 0 "[ . 1 . 2]" 2
497 1 4 ILE QG 1 45 MET H 5.000 . 5.000 6.472 6.142 6.862 1.862 8 20 [*******+*****-******] 2
498 1 31 GLU QB 1 45 MET H 5.000 . 5.000 3.535 2.046 4.263 . 0 0 "[ . 1 . 2]" 2
499 1 17 THR HB 1 45 MET H 5.000 . 5.000 4.926 4.336 5.037 0.037 12 0 "[ . 1 . 2]" 2
500 1 26 ASN HA 1 48 GLY H 5.000 . 5.000 3.753 3.401 3.927 . 0 0 "[ . 1 . 2]" 2
501 1 43 THR HB 1 49 GLU H 5.000 . 5.000 3.965 3.369 4.430 . 0 0 "[ . 1 . 2]" 2
502 1 20 LEU HG 1 49 GLU H 3.500 . 3.500 2.927 2.061 3.483 . 0 0 "[ . 1 . 2]" 2
503 1 31 GLU QB 1 51 TYR H 5.000 . 5.000 11.213 10.182 12.442 7.442 9 20 [********+****-******] 2
504 1 8 VAL QG 1 53 LEU H 5.000 . 5.000 3.607 3.240 3.801 . 0 0 "[ . 1 . 2]" 2
505 1 3 THR MG 1 55 LEU H 5.000 . 5.000 3.009 1.973 4.351 . 0 0 "[ . 1 . 2]" 2
506 1 4 ILE QG 1 55 LEU H 5.000 . 5.000 2.849 2.347 3.294 . 0 0 "[ . 1 . 2]" 2
507 1 33 VAL QG 1 56 PHE H 5.000 . 5.000 4.799 4.337 5.009 0.009 13 0 "[ . 1 . 2]" 2
508 1 27 LYS H 1 57 ASP H 5.000 . 5.000 2.618 2.251 3.622 . 0 0 "[ . 1 . 2]" 2
509 1 20 LEU QD 1 57 ASP H 5.000 . 5.000 4.683 4.251 4.857 . 0 0 "[ . 1 . 2]" 2
510 1 4 ILE QG 1 58 THR H 5.000 . 5.000 2.758 1.914 4.298 . 0 0 "[ . 1 . 2]" 2
511 1 8 VAL QG 1 58 THR H 5.000 . 5.000 2.664 1.913 3.523 . 0 0 "[ . 1 . 2]" 2
512 1 4 ILE QG 1 61 LEU H 5.000 . 5.000 2.840 1.809 3.738 . 0 0 "[ . 1 . 2]" 2
513 1 1 MET ME 1 63 ASP H 3.500 . 3.500 2.754 1.997 3.659 0.159 18 0 "[ . 1 . 2]" 2
514 1 17 THR HB 1 63 ASP H 5.000 . 5.000 4.560 3.524 5.203 0.203 17 0 "[ . 1 . 2]" 2
515 1 1 MET ME 1 64 TYR H 5.000 . 5.000 4.476 3.628 4.875 . 0 0 "[ . 1 . 2]" 2
516 1 7 VAL HB 1 70 LEU H 5.000 . 5.000 4.314 3.185 4.981 . 0 0 "[ . 1 . 2]" 2
517 1 69 PRO QD 1 72 TYR H 5.000 . 5.000 5.139 5.007 5.459 0.459 18 0 "[ . 1 . 2]" 2
518 1 12 GLY QA 1 72 TYR H 5.000 . 5.000 5.028 4.605 5.236 0.236 14 0 "[ . 1 . 2]" 2
519 1 75 THR H 1 103 HIS HD2 5.000 . 5.000 13.403 12.147 14.472 9.472 7 20 [******+********-****] 2
520 1 7 VAL QG 1 75 THR H 5.000 . 5.000 4.342 3.071 4.932 . 0 0 "[ . 1 . 2]" 2
521 1 4 ILE MD 1 78 PHE H 5.000 . 5.000 5.034 4.925 5.153 0.153 8 0 "[ . 1 . 2]" 2
522 1 9 VAL QG 1 79 LEU H 5.000 . 5.000 3.799 3.198 4.103 . 0 0 "[ . 1 . 2]" 2
523 1 12 GLY QA 1 83 SER H 5.000 . 5.000 4.427 2.988 5.053 0.053 20 0 "[ . 1 . 2]" 2
524 1 28 PHE HA 1 84 VAL H 5.000 . 5.000 8.829 8.026 10.246 5.246 13 20 [*********-**+*******] 2
525 1 8 VAL QG 1 86 SER H 5.000 . 5.000 3.664 1.876 4.557 . 0 0 "[ . 1 . 2]" 2
526 1 12 GLY QA 1 86 SER H 5.000 . 5.000 4.988 4.917 5.031 0.031 16 0 "[ . 1 . 2]" 2
527 1 24 THR H 1 86 SER H 3.500 . 3.500 3.124 2.269 3.574 0.074 4 0 "[ . 1 . 2]" 2
528 1 11 ASP QB 1 89 SER H 5.000 . 5.000 4.017 3.785 4.517 . 0 0 "[ . 1 . 2]" 2
529 1 17 THR HB 1 89 SER H 5.000 . 5.000 7.500 6.057 8.280 3.280 3 20 [**+***********-*****] 2
530 1 40 TYR QE 1 89 SER H 5.000 . 5.000 21.473 20.335 22.950 17.950 20 20 [-******************+] 2
531 1 23 TYR H 1 96 LYS H 3.500 . 3.500 1.988 1.875 2.065 . 0 0 "[ . 1 . 2]" 2
532 1 11 ASP QB 1 97 TRP HE1 5.000 . 5.000 2.632 2.029 3.561 . 0 0 "[ . 1 . 2]" 2
533 1 4 ILE QG 1 97 TRP HE1 5.000 . 5.000 4.260 3.228 4.987 . 0 0 "[ . 1 . 2]" 2
534 1 24 THR HA 1 97 TRP HE1 5.000 . 5.000 4.964 4.753 5.018 0.018 19 0 "[ . 1 . 2]" 2
535 1 4 ILE MD 1 98 VAL H 3.500 . 3.500 5.055 4.075 5.900 2.400 18 20 [***************-*+**] 2
536 1 4 ILE MD 1 101 ILE H 5.000 . 5.000 3.917 3.554 4.374 . 0 0 "[ . 1 . 2]" 2
537 1 38 ASP H 1 104 HIS H 5.000 . 5.000 15.595 14.843 16.266 11.266 7 20 [******+-************] 2
538 1 26 ASN QB 1 111 LEU H 5.000 . 5.000 2.699 2.169 3.072 . 0 0 "[ . 1 . 2]" 2
539 1 32 TYR QE 1 111 LEU H 5.000 . 5.000 3.516 2.007 4.252 . 0 0 "[ . 1 . 2]" 2
540 1 4 ILE MD 1 111 LEU H 3.500 . 3.500 2.871 2.383 3.293 . 0 0 "[ . 1 . 2]" 2
541 1 32 TYR QE 1 112 LEU H 5.000 . 5.000 4.005 3.241 4.890 . 0 0 "[ . 1 . 2]" 2
542 1 25 THR HB 1 119 LEU H 5.000 . 5.000 4.601 3.909 5.025 0.025 7 0 "[ . 1 . 2]" 2
543 1 31 GLU QB 1 119 LEU H 5.000 . 5.000 4.556 3.996 4.993 . 0 0 "[ . 1 . 2]" 2
544 1 9 VAL QG 1 120 ARG H 5.000 . 5.000 2.821 1.904 3.583 . 0 0 "[ . 1 . 2]" 2
545 1 7 VAL QG 1 121 ASP H 5.000 . 5.000 3.827 3.305 4.340 . 0 0 "[ . 1 . 2]" 2
546 1 120 ARG H 1 121 ASP H 3.500 . 3.500 2.500 1.957 2.766 . 0 0 "[ . 1 . 2]" 2
547 1 1 MET HA 1 122 ASP H 5.000 . 5.000 4.088 3.311 4.372 . 0 0 "[ . 1 . 2]" 2
548 1 11 ASP H 1 125 THR H 5.000 . 5.000 4.151 3.932 4.721 . 0 0 "[ . 1 . 2]" 2
549 1 7 VAL QG 1 126 ILE H 5.000 . 5.000 2.399 1.894 2.711 . 0 0 "[ . 1 . 2]" 2
550 1 1 MET QB 1 130 ALA H 5.000 . 5.000 3.896 3.681 4.082 . 0 0 "[ . 1 . 2]" 2
551 1 4 ILE QG 1 131 LYS H 3.500 . 3.500 3.574 3.462 3.653 0.153 19 0 "[ . 1 . 2]" 2
552 1 83 SER H 1 132 ASN H 3.500 . 3.500 2.153 2.011 2.268 . 0 0 "[ . 1 . 2]" 2
553 1 4 ILE HB 1 132 ASN H 5.000 . 5.000 3.778 3.367 4.047 . 0 0 "[ . 1 . 2]" 2
554 1 3 THR HB 1 134 GLN H 5.000 . 5.000 4.410 3.879 5.026 0.026 19 0 "[ . 1 . 2]" 2
555 1 31 GLU QB 1 134 GLN QE 5.000 . 5.000 4.209 2.934 4.952 . 0 0 "[ . 1 . 2]" 2
556 1 4 ILE MD 1 135 LYS H 5.000 . 5.000 3.611 2.026 4.965 . 0 0 "[ . 1 . 2]" 2
557 1 2 GLN QE 1 142 ALA H 5.000 . 5.000 4.373 3.463 4.946 . 0 0 "[ . 1 . 2]" 2
558 1 19 LEU HA 1 143 GLU H 5.000 . 5.000 3.487 3.364 3.659 . 0 0 "[ . 1 . 2]" 2
559 1 17 THR MG 1 145 LEU H 5.000 . 5.000 4.044 3.558 4.440 . 0 0 "[ . 1 . 2]" 2
560 1 2 GLN QE 1 145 LEU H 5.000 . 5.000 4.496 3.246 5.033 0.033 13 0 "[ . 1 . 2]" 2
561 1 120 ARG H 1 147 ARG H 5.000 . 5.000 3.934 3.678 4.322 . 0 0 "[ . 1 . 2]" 2
562 1 61 LEU H 1 147 ARG H 3.500 . 3.500 2.355 2.175 2.544 . 0 0 "[ . 1 . 2]" 2
563 1 2 GLN QG 1 148 ASP H 5.000 . 5.000 11.373 10.646 12.145 7.145 5 20 [****+*******-*******] 2
564 1 7 VAL QG 1 149 LEU H 3.500 . 3.500 2.783 1.663 3.175 . 0 0 "[ . 1 . 2]" 2
565 1 3 THR H 1 152 VAL H 5.000 . 5.000 3.766 3.168 4.158 . 0 0 "[ . 1 . 2]" 2
566 1 10 GLY H 1 152 VAL H 5.000 . 5.000 2.746 2.575 3.126 . 0 0 "[ . 1 . 2]" 2
567 1 4 ILE MD 1 152 VAL H 5.000 . 5.000 3.769 2.911 4.798 . 0 0 "[ . 1 . 2]" 2
568 1 21 ILE QG 1 152 VAL H 5.000 . 5.000 3.714 2.931 4.611 . 0 0 "[ . 1 . 2]" 2
569 1 6 CYS QB 1 153 LYS H 5.000 . 5.000 4.291 4.041 4.980 . 0 0 "[ . 1 . 2]" 2
570 1 7 VAL QG 1 156 GLU H 5.000 . 5.000 4.207 3.807 4.542 . 0 0 "[ . 1 . 2]" 2
571 1 7 VAL QG 1 157 CYS H 5.000 . 5.000 2.396 2.046 3.381 . 0 0 "[ . 1 . 2]" 2
572 1 2 GLN QB 1 157 CYS H 5.000 . 5.000 4.892 4.696 4.992 . 0 0 "[ . 1 . 2]" 2
573 1 3 THR MG 1 158 SER H 5.000 . 5.000 2.324 1.917 3.015 . 0 0 "[ . 1 . 2]" 2
574 1 25 THR HB 1 158 SER H 5.000 . 5.000 4.857 4.579 5.006 0.006 11 0 "[ . 1 . 2]" 2
575 1 7 VAL QG 1 159 ALA H 5.000 . 5.000 4.637 3.689 4.906 . 0 0 "[ . 1 . 2]" 2
576 1 36 VAL QG 1 160 LEU H 5.000 . 5.000 2.248 1.680 3.313 . 0 0 "[ . 1 . 2]" 2
577 1 3 THR MG 1 161 THR H 3.500 . 3.500 2.621 1.732 3.461 . 0 0 "[ . 1 . 2]" 2
578 1 56 PHE QE 1 161 THR H 5.000 . 5.000 2.887 2.301 3.821 . 0 0 "[ . 1 . 2]" 2
579 1 9 VAL HB 1 162 GLN QE 5.000 . 5.000 9.350 8.922 10.267 5.267 16 20 [****-**********+****] 2
580 1 9 VAL HB 1 162 GLN QE 5.000 . 5.000 4.954 4.470 5.250 0.250 15 0 "[ . 1 . 2]" 2
581 1 9 VAL HA 1 162 GLN QE 5.000 . 5.000 4.578 3.309 5.032 0.032 15 0 "[ . 1 . 2]" 2
582 1 8 VAL QG 1 162 GLN QE 5.000 . 5.000 1.836 1.572 2.246 . 0 0 "[ . 1 . 2]" 2
583 1 9 VAL HA 1 162 GLN QE 5.000 . 5.000 4.578 3.309 5.032 0.032 15 0 "[ . 1 . 2]" 2
584 1 4 ILE HA 1 163 LYS H 5.000 . 5.000 4.728 4.129 5.049 0.049 15 0 "[ . 1 . 2]" 2
585 1 7 VAL QG 1 163 LYS H 5.000 . 5.000 9.908 9.494 10.463 5.463 19 20 [*****************-+*] 2
586 1 40 TYR HA 1 163 LYS H 5.000 . 5.000 5.042 4.613 5.310 0.310 15 0 "[ . 1 . 2]" 2
587 1 8 VAL QG 1 165 LEU H 5.000 . 5.000 2.711 1.858 3.322 . 0 0 "[ . 1 . 2]" 2
588 1 65 ASP QB 1 166 LYS H 5.000 . 5.000 4.111 3.871 4.343 . 0 0 "[ . 1 . 2]" 2
589 1 1 MET QB 1 167 ASN QD 5.000 . 5.000 3.965 2.976 4.621 . 0 0 "[ . 1 . 2]" 2
590 1 2 GLN QB 1 169 PHE H 5.000 . 5.000 4.650 4.030 4.864 . 0 0 "[ . 1 . 2]" 2
591 1 19 LEU HA 1 170 ASP H 5.000 . 5.000 4.069 3.641 4.338 . 0 0 "[ . 1 . 2]" 2
592 1 31 GLU QB 1 170 ASP H 5.000 . 5.000 4.676 4.269 4.973 . 0 0 "[ . 1 . 2]" 2
593 1 4 ILE QG 1 170 ASP H 5.000 . 5.000 3.532 2.848 4.298 . 0 0 "[ . 1 . 2]" 2
594 1 169 PHE H 1 170 ASP H 5.000 . 5.000 2.631 2.410 2.824 . 0 0 "[ . 1 . 2]" 2
595 1 46 ILE QG 1 171 GLU H 5.000 . 5.000 3.943 3.790 4.189 . 0 0 "[ . 1 . 2]" 2
596 1 4 ILE QG 1 172 ALA H 5.000 . 5.000 3.858 3.311 4.302 . 0 0 "[ . 1 . 2]" 2
597 1 7 VAL QG 1 173 ILE H 5.000 . 5.000 3.671 3.348 3.928 . 0 0 "[ . 1 . 2]" 2
598 1 2 GLN QB 1 173 ILE H 5.000 . 5.000 3.787 3.572 4.088 . 0 0 "[ . 1 . 2]" 2
599 1 20 LEU H 1 175 ALA H 5.000 . 5.000 3.936 3.612 4.603 . 0 0 "[ . 1 . 2]" 2
600 1 9 VAL QG 1 175 ALA H 5.000 . 5.000 3.360 2.396 3.847 . 0 0 "[ . 1 . 2]" 2
601 1 33 VAL QG 1 175 ALA H 5.000 . 5.000 3.812 3.112 4.313 . 0 0 "[ . 1 . 2]" 2
602 1 2 GLN QB 1 176 ALA H 5.000 . 5.000 4.355 3.816 4.723 . 0 0 "[ . 1 . 2]" 2
603 1 4 ILE MG 1 176 ALA H 5.000 . 5.000 3.451 3.149 3.929 . 0 0 "[ . 1 . 2]" 2
604 1 33 VAL QG 1 176 ALA H 5.000 . 5.000 3.803 3.462 4.346 . 0 0 "[ . 1 . 2]" 2
605 1 48 GLY QA 1 178 GLU H 5.000 . 5.000 2.894 1.872 4.320 . 0 0 "[ . 1 . 2]" 2
606 1 31 GLU QB 2 36 GLN QE 6.000 . 6.000 4.069 2.123 6.040 0.040 15 0 "[ . 1 . 2]" 2
607 1 3 THR HB 2 36 GLN QE 5.000 . 5.000 4.982 4.887 5.078 0.078 6 0 "[ . 1 . 2]" 2
608 1 45 MET HA 2 5 LEU H 5.000 . 5.000 8.394 7.872 8.828 3.828 8 20 [*******+****-*******] 2
609 1 1 MET QB 2 4 SER H 6.000 . 6.000 3.836 2.906 4.381 . 0 0 "[ . 1 . 2]" 2
610 1 2 GLN QB 2 5 LEU H 5.000 . 5.000 4.050 3.611 4.362 . 0 0 "[ . 1 . 2]" 2
611 1 7 VAL QG 2 10 GLU H 6.000 . 6.000 2.708 2.162 3.365 . 0 0 "[ . 1 . 2]" 2
612 1 4 ILE H 2 12 THR H 5.000 . 5.000 3.868 3.570 4.194 . 0 0 "[ . 1 . 2]" 2
613 1 4 ILE QG 2 13 ILE H 5.000 . 5.000 2.607 2.355 2.759 . 0 0 "[ . 1 . 2]" 2
614 1 43 THR HB 2 13 ILE H 5.000 . 5.000 3.565 3.532 3.597 . 0 0 "[ . 1 . 2]" 2
615 1 21 ILE QG 2 13 ILE H 5.000 . 5.000 2.690 2.395 2.860 . 0 0 "[ . 1 . 2]" 2
616 1 27 LYS H 2 13 ILE H 5.000 . 5.000 5.158 5.058 5.273 0.273 17 0 "[ . 1 . 2]" 2
617 1 11 ASP H 2 14 HIS H 6.000 . 6.000 4.005 3.761 4.172 . 0 0 "[ . 1 . 2]" 2
618 1 27 LYS H 2 15 VAL H 5.000 . 5.000 4.158 3.468 4.642 . 0 0 "[ . 1 . 2]" 2
619 1 40 TYR HA 2 17 PHE H 6.000 . 6.000 4.823 4.683 4.995 . 0 0 "[ . 1 . 2]" 2
620 1 48 GLY H 2 18 ASP H 5.000 . 5.000 3.827 3.734 3.912 . 0 0 "[ . 1 . 2]" 2
621 1 20 LEU QD 2 19 ALA H 6.000 . 6.000 4.633 4.072 4.958 . 0 0 "[ . 1 . 2]" 2
622 1 4 ILE QG 2 19 ALA H 5.000 . 5.000 3.995 3.535 4.250 . 0 0 "[ . 1 . 2]" 2
623 1 19 LEU HA 2 21 THR H 6.000 . 6.000 3.813 3.626 4.164 . 0 0 "[ . 1 . 2]" 2
624 1 3 THR H 2 22 GLY H 5.000 . 5.000 4.159 3.708 4.595 . 0 0 "[ . 1 . 2]" 2
625 1 10 GLY H 2 22 GLY H 6.000 . 6.000 5.472 4.912 5.929 . 0 0 "[ . 1 . 2]" 2
626 1 33 VAL QG 2 22 GLY H 6.000 . 6.000 3.588 3.038 4.839 . 0 0 "[ . 1 . 2]" 2
627 1 29 PRO HA 2 22 GLY H 5.000 . 5.000 4.274 3.739 4.646 . 0 0 "[ . 1 . 2]" 2
628 1 2 GLN QG 2 22 GLY H 5.000 . 5.000 3.700 3.212 4.277 . 0 0 "[ . 1 . 2]" 2
629 1 8 VAL QG 2 23 GLU H 5.000 . 5.000 2.812 2.265 4.342 . 0 0 "[ . 1 . 2]" 2
630 1 2 GLN QG 2 23 GLU H 5.000 . 5.000 2.265 2.000 2.564 . 0 0 "[ . 1 . 2]" 2
631 1 17 THR HA 2 23 GLU H 5.000 . 5.000 4.910 4.693 5.014 0.014 11 0 "[ . 1 . 2]" 2
632 1 93 VAL H 2 24 PHE H 6.000 . 6.000 4.839 4.233 5.303 . 0 0 "[ . 1 . 2]" 2
633 1 20 LEU QD 2 24 PHE H 6.000 . 6.000 3.989 3.837 4.165 . 0 0 "[ . 1 . 2]" 2
634 1 1 MET ME 2 24 PHE H 5.000 . 5.000 2.066 1.930 2.457 . 0 0 "[ . 1 . 2]" 2
635 1 20 LEU QD 2 27 MET H 5.000 . 5.000 3.606 3.197 3.953 . 0 0 "[ . 1 . 2]" 2
636 1 21 ILE QG 2 27 MET H 6.000 . 6.000 3.846 3.323 4.385 . 0 0 "[ . 1 . 2]" 2
637 1 4 ILE QG 2 27 MET H 5.000 . 5.000 3.660 3.218 4.036 . 0 0 "[ . 1 . 2]" 2
638 1 1 MET QB 2 29 GLU H 3.500 . 3.500 2.236 2.022 2.535 . 0 0 "[ . 1 . 2]" 2
639 1 83 SER H 2 30 GLN H 6.000 . 6.000 4.344 4.062 4.641 . 0 0 "[ . 1 . 2]" 2
640 1 1 MET QB 2 30 GLN H 5.000 . 5.000 2.459 2.164 2.825 . 0 0 "[ . 1 . 2]" 2
641 1 21 ILE QG 2 30 GLN H 6.000 . 6.000 4.547 4.137 4.876 . 0 0 "[ . 1 . 2]" 2
642 1 33 VAL QG 2 30 GLN QE 5.000 . 5.000 3.539 2.107 4.698 . 0 0 "[ . 1 . 2]" 2
643 1 33 VAL QG 2 30 GLN QE 5.000 . 5.000 3.539 2.107 4.698 . 0 0 "[ . 1 . 2]" 2
644 1 4 ILE QG 2 31 TRP H 5.000 . 5.000 2.193 1.926 2.557 . 0 0 "[ . 1 . 2]" 2
645 1 21 ILE QG 2 31 TRP H 5.000 . 5.000 4.357 4.205 4.552 . 0 0 "[ . 1 . 2]" 2
646 1 1 MET QB 2 31 TRP H 5.000 . 5.000 2.188 1.924 2.553 . 0 0 "[ . 1 . 2]" 2
647 1 18 CYS QB 2 31 TRP HE1 5.000 . 5.000 4.642 4.132 5.081 0.081 15 0 "[ . 1 . 2]" 2
648 1 9 VAL HA 2 31 TRP HE1 5.000 . 5.000 4.570 4.356 4.819 . 0 0 "[ . 1 . 2]" 2
649 1 42 VAL QG 2 31 TRP HE1 6.000 . 6.000 5.584 4.005 5.958 . 0 0 "[ . 1 . 2]" 2
650 1 32 TYR QD 2 31 TRP HE1 5.000 . 5.000 4.561 4.204 4.716 . 0 0 "[ . 1 . 2]" 2
651 1 70 LEU QB 2 31 TRP HE1 5.000 . 5.000 2.401 1.794 3.718 . 0 0 "[ . 1 . 2]" 2
652 1 31 GLU QB 2 32 ALA H 5.000 . 5.000 2.794 2.589 3.250 . 0 0 "[ . 1 . 2]" 2
653 1 32 TYR QD 2 33 ARG H 5.000 . 5.000 4.632 4.240 4.818 . 0 0 "[ . 1 . 2]" 2
654 1 4 ILE HB 2 34 LEU H 5.000 . 5.000 3.608 2.037 3.969 . 0 0 "[ . 1 . 2]" 2
655 1 20 LEU HG 2 35 LEU H 6.000 . 6.000 4.689 4.265 5.199 . 0 0 "[ . 1 . 2]" 2
656 1 4 ILE HB 2 35 LEU H 3.500 . 3.500 2.157 1.840 2.410 . 0 0 "[ . 1 . 2]" 2
657 1 33 VAL QG 2 35 LEU H 5.000 . 5.000 3.620 3.358 3.882 . 0 0 "[ . 1 . 2]" 2
658 1 4 ILE HB 2 36 GLN H 5.000 . 5.000 3.597 1.937 3.942 . 0 0 "[ . 1 . 2]" 2
659 1 68 ARG H 2 36 GLN H 5.000 . 5.000 4.123 3.811 4.424 . 0 0 "[ . 1 . 2]" 2
660 1 65 ASP H 2 36 GLN H 5.000 . 5.000 2.558 2.416 2.613 . 0 0 "[ . 1 . 2]" 2
661 1 1 MET QG 2 36 GLN H 5.000 . 5.000 3.257 1.852 4.039 . 0 0 "[ . 1 . 2]" 2
662 1 2 GLN QB 2 36 GLN QE 6.000 . 6.000 4.990 4.611 5.680 . 0 0 "[ . 1 . 2]" 2
663 1 21 ILE QG 2 36 GLN QE 6.000 . 6.000 3.251 1.800 5.531 . 0 0 "[ . 1 . 2]" 2
664 1 17 THR HA 2 37 THR H 5.000 . 5.000 3.552 3.347 4.368 . 0 0 "[ . 1 . 2]" 2
665 1 17 THR HA 2 38 SER H 5.000 . 5.000 4.256 3.964 4.923 . 0 0 "[ . 1 . 2]" 2
666 1 79 LEU HA 2 38 SER H 5.000 . 5.000 4.870 4.141 5.234 0.234 18 0 "[ . 1 . 2]" 2
667 1 1 MET HA 2 38 SER H 3.500 . 3.500 2.897 2.483 3.205 . 0 0 "[ . 1 . 2]" 2
668 1 43 THR HB 2 38 SER H 3.500 . 3.500 2.831 2.483 3.511 0.011 20 0 "[ . 1 . 2]" 2
669 1 22 SER HA 2 39 ASN H 6.000 . 6.000 4.831 3.523 5.648 . 0 0 "[ . 1 . 2]" 2
670 1 22 SER HA 2 39 ASN QD 6.000 . 6.000 4.480 3.212 5.393 . 0 0 "[ . 1 . 2]" 2
671 1 43 THR HB 2 40 ILE H 6.000 . 6.000 3.655 2.936 4.237 . 0 0 "[ . 1 . 2]" 2
672 1 11 ASP QB 2 40 ILE H 5.000 . 5.000 3.101 1.915 4.048 . 0 0 "[ . 1 . 2]" 2
673 1 29 PRO HA 2 41 THR H 3.500 . 3.500 2.213 2.174 2.238 . 0 0 "[ . 1 . 2]" 2
674 1 79 LEU HA 2 41 THR H 5.000 . 5.000 5.129 4.978 5.390 0.390 14 0 "[ . 1 . 2]" 2
675 1 80 VAL HA 2 42 LYS H 3.500 . 3.500 3.230 2.261 3.529 0.029 8 0 "[ . 1 . 2]" 2
676 1 79 LEU HA 2 43 SER H 5.000 . 5.000 5.090 4.971 5.229 0.229 19 0 "[ . 1 . 2]" 2
677 1 36 VAL QG 1 64 TYR QE 5.000 . 5.000 2.446 1.832 3.335 . 0 0 "[ . 1 . 2]" 2
678 1 28 PHE HZ 1 79 LEU QD 5.000 . 5.000 8.777 7.893 9.692 4.692 6 20 [**-**+**************] 2
679 1 21 ILE MG 1 64 TYR QE 5.000 . 5.000 2.344 1.831 3.036 . 0 0 "[ . 1 . 2]" 2
680 1 21 ILE MG 1 28 PHE HZ 5.000 . 5.000 2.917 1.907 3.960 . 0 0 "[ . 1 . 2]" 2
681 1 21 ILE MG 1 64 TYR QE 3.500 . 3.500 2.344 1.831 3.036 . 0 0 "[ . 1 . 2]" 2
682 1 2 GLN QB 1 28 PHE HZ 5.000 . 5.000 3.608 2.689 4.280 . 0 0 "[ . 1 . 2]" 2
683 1 17 THR HB 1 40 TYR HA 3.500 . 3.500 7.994 7.273 8.589 5.089 15 20 [**-***********+*****] 2
684 1 5 LYS HA 1 64 TYR QE 5.000 . 5.000 4.213 3.861 4.434 . 0 0 "[ . 1 . 2]" 2
685 1 10 GLY H 1 64 TYR QE 5.000 . 5.000 4.399 4.010 4.708 . 0 0 "[ . 1 . 2]" 2
686 1 32 TYR QE 1 169 PHE H 5.000 . 5.000 11.980 11.068 12.697 7.697 19 20 [**************-***+*] 2
687 1 64 TYR QE 1 71 SER H 5.000 . 5.000 4.621 3.308 5.127 0.127 8 0 "[ . 1 . 2]" 2
688 1 38 ASP H 1 103 HIS HD2 5.000 . 5.000 16.384 15.653 17.237 12.237 11 20 [**********+******-**] 2
689 1 65 ASP H 1 103 HIS HD2 5.000 . 5.000 5.074 5.021 5.527 0.527 17 1 "[ . 1 . + 2]" 2
690 1 28 PHE HZ 1 160 LEU QD 5.000 . 5.000 2.944 1.908 4.061 . 0 0 "[ . 1 . 2]" 2
691 1 28 PHE HZ 1 89 SER H 5.000 . 5.000 8.220 7.487 9.868 4.868 13 20 [-***********+*******] 2
692 1 21 ILE MD 1 40 TYR QE 5.000 . 5.000 2.458 1.834 3.218 . 0 0 "[ . 1 . 2]" 2
693 1 20 LEU QD 1 40 TYR QE 3.500 . 3.500 2.989 2.396 3.439 . 0 0 "[ . 1 . 2]" 2
694 1 3 THR MG 1 40 TYR QE 5.000 . 5.000 3.205 2.422 3.963 . 0 0 "[ . 1 . 2]" 2
695 1 7 VAL QG 1 40 TYR QE 5.000 . 5.000 3.851 2.134 4.949 . 0 0 "[ . 1 . 2]" 2
696 1 1 MET ME 1 40 TYR QE 5.000 . 5.000 4.981 4.883 5.161 0.161 10 0 "[ . 1 . 2]" 2
697 1 20 LEU HG 1 40 TYR QE 5.000 . 5.000 4.407 2.822 4.982 . 0 0 "[ . 1 . 2]" 2
698 1 8 VAL HB 1 40 TYR QE 5.000 . 5.000 3.713 2.802 4.566 . 0 0 "[ . 1 . 2]" 2
699 1 11 ASP HA 1 40 TYR QE 5.000 . 5.000 5.116 5.006 5.225 0.225 15 0 "[ . 1 . 2]" 2
700 1 34 PRO HA 1 40 TYR QE 5.000 . 5.000 3.455 3.241 3.855 . 0 0 "[ . 1 . 2]" 2
701 1 2 GLN QE 1 40 TYR QE 5.000 . 5.000 5.100 4.959 5.253 0.253 12 0 "[ . 1 . 2]" 2
702 1 25 THR MG 1 90 PHE QD 5.000 . 5.000 3.443 2.567 4.171 . 0 0 "[ . 1 . 2]" 2
703 1 70 LEU QD 1 90 PHE QD 5.000 . 5.000 3.835 2.943 4.847 . 0 0 "[ . 1 . 2]" 2
704 1 79 LEU QD 1 90 PHE QD 5.000 . 5.000 2.770 1.909 3.574 . 0 0 "[ . 1 . 2]" 2
705 1 4 ILE MD 1 90 PHE QD 5.000 . 5.000 4.636 4.067 4.866 . 0 0 "[ . 1 . 2]" 2
706 1 3 THR MG 1 90 PHE QD 5.000 . 5.000 4.562 3.399 5.000 . 7 0 "[ . 1 . 2]" 2
707 1 7 VAL QG 1 90 PHE QD 5.000 . 5.000 3.329 2.667 3.900 . 0 0 "[ . 1 . 2]" 2
708 1 43 THR HB 1 90 PHE QD 3.500 . 3.500 2.427 2.014 2.730 . 0 0 "[ . 1 . 2]" 2
709 1 2 GLN HA 1 90 PHE QD 5.000 . 5.000 3.191 2.066 4.420 . 0 0 "[ . 1 . 2]" 2
710 1 37 PHE H 1 90 PHE QD 5.000 . 5.000 3.587 2.748 4.784 . 0 0 "[ . 1 . 2]" 2
711 1 28 PHE H 1 90 PHE QD 5.000 . 5.000 3.809 3.432 4.320 . 0 0 "[ . 1 . 2]" 2
712 1 29 PRO HA 1 103 HIS HD2 5.000 . 5.000 3.497 2.127 4.313 . 0 0 "[ . 1 . 2]" 2
713 1 46 ILE QG 2 3 ILE MD 5.000 . 5.000 2.204 1.769 3.184 . 0 0 "[ . 1 . 2]" 2
714 1 7 VAL HB 2 3 ILE MD 3.500 . 3.500 2.898 2.049 3.474 . 0 0 "[ . 1 . 2]" 2
715 1 1 MET QB 2 3 ILE MD 5.000 . 5.000 2.326 2.028 2.661 . 0 0 "[ . 1 . 2]" 2
716 1 1 MET QG 2 3 ILE MD 5.000 . 5.000 3.401 2.182 3.998 . 0 0 "[ . 1 . 2]" 2
717 1 24 THR HB 2 3 ILE MD 5.000 . 5.000 4.305 3.377 4.873 . 0 0 "[ . 1 . 2]" 2
718 1 29 PRO HA 2 3 ILE MD 3.500 . 3.500 2.084 1.836 2.682 . 0 0 "[ . 1 . 2]" 2
719 1 25 THR MG 2 9 PHE QD 5.000 . 5.000 3.216 1.900 4.520 . 0 0 "[ . 1 . 2]" 2
720 1 3 THR MG 2 9 PHE QD 5.000 . 5.000 2.477 1.678 3.225 . 0 0 "[ . 1 . 2]" 2
721 1 25 THR MG 2 9 PHE QE 5.000 . 5.000 2.833 2.270 3.638 . 0 0 "[ . 1 . 2]" 2
722 1 7 VAL QG 2 10 GLU QG 5.000 . 5.000 2.393 1.842 4.239 . 0 0 "[ . 1 . 2]" 2
723 1 7 VAL QG 2 12 THR MG 3.500 . 3.500 3.578 3.534 3.648 0.148 12 0 "[ . 1 . 2]" 2
724 1 79 LEU HA 2 13 ILE MD 3.500 . 3.500 14.947 14.381 15.613 12.113 20 20 [************-******+] 2
725 1 79 LEU HA 2 14 HIS HD2 3.500 . 3.500 20.778 17.538 22.514 19.014 20 20 [*****-*************+] 2
726 1 12 GLY QA 2 15 VAL QG 5.000 . 5.000 4.118 3.988 4.524 . 0 0 "[ . 1 . 2]" 2
727 1 36 VAL QG 2 15 VAL QG 3.500 . 3.500 1.923 1.643 2.176 . 0 0 "[ . 1 . 2]" 2
728 1 35 THR H 2 15 VAL QG 5.000 . 5.000 1.932 1.645 2.186 . 0 0 "[ . 1 . 2]" 2
729 1 12 GLY QA 2 15 VAL QG 5.000 . 5.000 4.118 3.988 4.524 . 0 0 "[ . 1 . 2]" 2
730 1 64 TYR QE 2 24 PHE QE 5.000 . 5.000 3.888 3.013 4.949 . 0 0 "[ . 1 . 2]" 2
731 1 70 LEU QB 2 27 MET ME 3.500 . 3.500 3.365 2.835 3.651 0.151 15 0 "[ . 1 . 2]" 2
732 1 35 THR H 2 27 MET ME 3.500 . 3.500 3.395 2.863 3.672 0.172 15 0 "[ . 1 . 2]" 2
733 1 43 THR HB 2 27 MET ME 5.000 . 5.000 5.176 5.097 5.328 0.328 18 0 "[ . 1 . 2]" 2
734 1 27 LYS H 2 27 MET ME 5.000 . 5.000 4.879 4.581 5.092 0.092 5 0 "[ . 1 . 2]" 2
735 1 17 THR HA 2 31 TRP HZ2 5.000 . 5.000 4.426 2.692 5.071 0.071 18 0 "[ . 1 . 2]" 2
736 1 46 ILE QG 2 35 LEU QD 5.000 . 5.000 2.168 1.650 3.256 . 0 0 "[ . 1 . 2]" 2
737 1 66 ARG QG 2 35 LEU QD 3.500 . 3.500 2.882 1.763 3.320 . 0 0 "[ . 1 . 2]" 2
738 1 2 GLN QB 2 35 LEU QD 5.000 . 5.000 2.262 1.740 3.664 . 0 0 "[ . 1 . 2]" 2
739 1 70 LEU QB 2 35 LEU QD 3.500 . 3.500 2.230 1.631 3.489 . 0 0 "[ . 1 . 2]" 2
740 1 66 ARG QD 2 35 LEU QD 3.500 . 3.500 3.411 3.050 3.601 0.101 14 0 "[ . 1 . 2]" 2
741 1 46 ILE MG 2 35 LEU QD 2.800 . 2.800 1.780 1.520 2.116 . 0 0 "[ . 1 . 2]" 2
742 1 70 LEU QB 2 35 LEU QD 3.500 . 3.500 2.230 1.631 3.489 . 0 0 "[ . 1 . 2]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 6
_Distance_constraint_stats_list.Viol_count 54
_Distance_constraint_stats_list.Viol_total 69.983
_Distance_constraint_stats_list.Viol_max 0.317
_Distance_constraint_stats_list.Viol_rms 0.0610
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0292
_Distance_constraint_stats_list.Viol_average_violations_only 0.0648
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 17 THR 3.227 0.317 3 0 "[ . 1 . 2]"
1 35 THR 3.190 0.317 3 0 "[ . 1 . 2]"
4 1 MG 0.229 0.089 11 0 "[ . 1 . 2]"
5 2 HOH 0.352 0.041 10 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 17 THR OG1 4 1 MG MG 2.300 2.200 2.400 2.381 2.332 2.489 0.089 11 0 "[ . 1 . 2]" 3
2 1 35 THR OG1 4 1 MG MG 2.300 2.200 2.400 2.379 2.328 2.419 0.019 2 0 "[ . 1 . 2]" 3
3 4 1 MG MG 5 2 HOH O 2.300 2.200 2.400 2.372 2.358 2.395 . 0 0 "[ . 1 . 2]" 3
4 1 17 THR OG1 5 2 HOH O 3.250 3.050 3.450 3.418 3.275 3.473 0.023 19 0 "[ . 1 . 2]" 3
5 1 35 THR OG1 5 2 HOH O 3.250 3.050 3.450 3.288 3.019 3.491 0.041 10 0 "[ . 1 . 2]" 3
6 1 17 THR OG1 1 35 THR OG1 3.250 3.050 3.450 3.596 3.518 3.767 0.317 3 0 "[ . 1 . 2]" 3
stop_
save_
save_distance_constraint_statistics_4
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 4
_Distance_constraint_stats_list.Constraint_count 54
_Distance_constraint_stats_list.Viol_count 278
_Distance_constraint_stats_list.Viol_total 279.679
_Distance_constraint_stats_list.Viol_max 0.243
_Distance_constraint_stats_list.Viol_rms 0.0321
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0129
_Distance_constraint_stats_list.Viol_average_violations_only 0.0503
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 17 THR 2.092 0.243 10 0 "[ . 1 . 2]"
1 18 CYS 1.184 0.155 19 0 "[ . 1 . 2]"
1 19 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 20 LEU 1.962 0.233 16 0 "[ . 1 . 2]"
1 21 ILE 2.092 0.243 10 0 "[ . 1 . 2]"
1 22 SER 1.184 0.155 19 0 "[ . 1 . 2]"
1 23 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 THR 1.962 0.233 16 0 "[ . 1 . 2]"
1 90 PHE 0.195 0.041 10 0 "[ . 1 . 2]"
1 91 GLU 0.099 0.054 11 0 "[ . 1 . 2]"
1 92 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 93 VAL 0.172 0.056 18 0 "[ . 1 . 2]"
1 94 LYS 1.448 0.127 1 0 "[ . 1 . 2]"
1 95 GLU 0.099 0.054 11 0 "[ . 1 . 2]"
1 96 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 TRP 0.172 0.056 18 0 "[ . 1 . 2]"
1 98 VAL 1.253 0.127 1 0 "[ . 1 . 2]"
1 100 GLU 1.005 0.149 17 0 "[ . 1 . 2]"
1 104 HIS 1.005 0.149 17 0 "[ . 1 . 2]"
1 124 SER 0.301 0.096 2 0 "[ . 1 . 2]"
1 125 THR 0.013 0.013 17 0 "[ . 1 . 2]"
1 128 LYS 0.301 0.096 2 0 "[ . 1 . 2]"
1 129 LEU 0.013 0.013 17 0 "[ . 1 . 2]"
1 140 GLU 0.141 0.042 14 0 "[ . 1 . 2]"
1 141 THR 0.322 0.047 11 0 "[ . 1 . 2]"
1 142 ALA 0.472 0.053 4 0 "[ . 1 . 2]"
1 143 GLU 0.059 0.041 18 0 "[ . 1 . 2]"
1 144 LYS 0.391 0.049 11 0 "[ . 1 . 2]"
1 145 LEU 0.322 0.047 11 0 "[ . 1 . 2]"
1 146 ALA 0.472 0.053 4 0 "[ . 1 . 2]"
1 147 ARG 0.059 0.041 18 0 "[ . 1 . 2]"
1 148 ASP 0.250 0.049 11 0 "[ . 1 . 2]"
1 165 LEU 1.579 0.185 20 0 "[ . 1 . 2]"
1 166 LYS 0.191 0.072 13 0 "[ . 1 . 2]"
1 167 ASN 0.366 0.090 19 0 "[ . 1 . 2]"
1 168 VAL 0.053 0.038 15 0 "[ . 1 . 2]"
1 169 PHE 1.632 0.185 20 0 "[ . 1 . 2]"
1 170 ASP 0.342 0.072 13 0 "[ . 1 . 2]"
1 171 GLU 0.366 0.090 19 0 "[ . 1 . 2]"
1 172 ALA 0.053 0.038 15 0 "[ . 1 . 2]"
1 173 ILE 0.052 0.036 14 0 "[ . 1 . 2]"
1 174 LEU 0.150 0.034 12 0 "[ . 1 . 2]"
2 29 GLU 0.245 0.046 4 0 "[ . 1 . 2]"
2 30 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
2 31 TRP 1.616 0.118 14 0 "[ . 1 . 2]"
2 32 ALA 0.209 0.068 18 0 "[ . 1 . 2]"
2 33 ARG 0.245 0.046 4 0 "[ . 1 . 2]"
2 34 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
2 35 LEU 1.616 0.118 14 0 "[ . 1 . 2]"
2 36 GLN 0.209 0.068 18 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 17 THR O 1 21 ILE N 0.000 . 3.300 3.231 2.956 3.488 0.188 10 0 "[ . 1 . 2]" 4
2 1 17 THR O 1 21 ILE H 0.000 . 2.300 2.333 2.013 2.543 0.243 10 0 "[ . 1 . 2]" 4
3 1 18 CYS O 1 22 SER N 0.000 . 3.300 3.129 2.615 3.354 0.054 19 0 "[ . 1 . 2]" 4
4 1 18 CYS O 1 22 SER H 0.000 . 2.300 2.191 1.730 2.455 0.155 19 0 "[ . 1 . 2]" 4
5 1 19 LEU O 1 23 TYR N 0.000 . 3.300 2.500 2.449 2.638 . 0 0 "[ . 1 . 2]" 4
6 1 19 LEU O 1 23 TYR H 0.000 . 2.300 1.888 1.634 2.259 . 0 0 "[ . 1 . 2]" 4
7 1 20 LEU O 1 24 THR N 0.000 . 3.300 3.062 2.849 3.286 . 0 0 "[ . 1 . 2]" 4
8 1 20 LEU O 1 24 THR H 0.000 . 2.300 2.391 2.226 2.533 0.233 16 0 "[ . 1 . 2]" 4
9 1 90 PHE O 1 94 LYS N 0.000 . 3.300 3.165 2.996 3.275 . 0 0 "[ . 1 . 2]" 4
10 1 90 PHE O 1 94 LYS H 0.000 . 2.300 2.266 2.113 2.341 0.041 10 0 "[ . 1 . 2]" 4
11 1 91 GLU O 1 95 GLU N 0.000 . 3.300 3.120 2.730 3.293 . 0 0 "[ . 1 . 2]" 4
12 1 91 GLU O 1 95 GLU H 0.000 . 2.300 2.178 1.759 2.354 0.054 11 0 "[ . 1 . 2]" 4
13 1 92 ASN O 1 96 LYS N 0.000 . 3.300 2.543 2.508 2.773 . 0 0 "[ . 1 . 2]" 4
14 1 92 ASN O 1 96 LYS H 0.000 . 2.300 2.014 1.894 2.244 . 0 0 "[ . 1 . 2]" 4
15 1 93 VAL O 1 97 TRP N 0.000 . 3.300 2.889 2.530 3.213 . 0 0 "[ . 1 . 2]" 4
16 1 93 VAL O 1 97 TRP H 0.000 . 2.300 2.020 1.635 2.356 0.056 18 0 "[ . 1 . 2]" 4
17 1 94 LYS O 1 98 VAL N 0.000 . 3.300 3.145 2.976 3.212 . 0 0 "[ . 1 . 2]" 4
18 1 94 LYS O 1 98 VAL H 0.000 . 2.300 2.359 2.234 2.427 0.127 1 0 "[ . 1 . 2]" 4
19 1 100 GLU O 1 104 HIS N 0.000 . 3.300 3.238 3.115 3.344 0.044 17 0 "[ . 1 . 2]" 4
20 1 100 GLU O 1 104 HIS H 0.000 . 2.300 2.343 2.236 2.449 0.149 17 0 "[ . 1 . 2]" 4
21 1 124 SER O 1 128 LYS N 0.000 . 3.300 3.181 2.780 3.327 0.027 2 0 "[ . 1 . 2]" 4
22 1 124 SER O 1 128 LYS H 0.000 . 2.300 2.249 1.815 2.396 0.096 2 0 "[ . 1 . 2]" 4
23 1 125 THR O 1 129 LEU N 0.000 . 3.300 2.694 2.527 3.133 . 0 0 "[ . 1 . 2]" 4
24 1 125 THR O 1 129 LEU H 0.000 . 2.300 1.773 1.630 2.313 0.013 17 0 "[ . 1 . 2]" 4
25 1 140 GLU O 1 144 LYS N 0.000 . 3.300 3.051 2.758 3.252 . 0 0 "[ . 1 . 2]" 4
26 1 140 GLU O 1 144 LYS H 0.000 . 2.300 2.157 1.825 2.342 0.042 14 0 "[ . 1 . 2]" 4
27 1 141 THR O 1 145 LEU N 0.000 . 3.300 3.193 2.753 3.272 . 0 0 "[ . 1 . 2]" 4
28 1 141 THR O 1 145 LEU H 0.000 . 2.300 2.273 1.788 2.347 0.047 11 0 "[ . 1 . 2]" 4
29 1 142 ALA O 1 146 ALA N 0.000 . 3.300 3.224 3.132 3.285 . 0 0 "[ . 1 . 2]" 4
30 1 142 ALA O 1 146 ALA H 0.000 . 2.300 2.320 2.237 2.353 0.053 4 0 "[ . 1 . 2]" 4
31 1 143 GLU O 1 147 ARG N 0.000 . 3.300 2.964 2.529 3.280 . 0 0 "[ . 1 . 2]" 4
32 1 143 GLU O 1 147 ARG H 0.000 . 2.300 2.117 1.670 2.341 0.041 18 0 "[ . 1 . 2]" 4
33 1 144 LYS O 1 148 ASP N 0.000 . 3.300 3.124 2.734 3.280 . 0 0 "[ . 1 . 2]" 4
34 1 144 LYS O 1 148 ASP H 0.000 . 2.300 2.204 1.869 2.349 0.049 11 0 "[ . 1 . 2]" 4
35 1 165 LEU O 1 169 PHE N 0.000 . 3.300 3.203 2.752 3.421 0.121 20 0 "[ . 1 . 2]" 4
36 1 165 LEU O 1 169 PHE H 0.000 . 2.300 2.289 1.867 2.485 0.185 20 0 "[ . 1 . 2]" 4
37 1 166 LYS O 1 170 ASP N 0.000 . 3.300 2.974 2.580 3.252 . 0 0 "[ . 1 . 2]" 4
38 1 166 LYS O 1 170 ASP H 0.000 . 2.300 2.125 1.758 2.372 0.072 13 0 "[ . 1 . 2]" 4
39 1 167 ASN O 1 171 GLU N 0.000 . 3.300 3.157 2.822 3.290 . 0 0 "[ . 1 . 2]" 4
40 1 167 ASN O 1 171 GLU H 0.000 . 2.300 2.261 1.953 2.390 0.090 19 0 "[ . 1 . 2]" 4
41 1 168 VAL O 1 172 ALA N 0.000 . 3.300 2.821 2.517 3.275 . 0 0 "[ . 1 . 2]" 4
42 1 168 VAL O 1 172 ALA H 0.000 . 2.300 1.942 1.631 2.338 0.038 15 0 "[ . 1 . 2]" 4
43 1 169 PHE O 1 173 ILE N 0.000 . 3.300 2.799 2.519 3.215 . 0 0 "[ . 1 . 2]" 4
44 1 169 PHE O 1 173 ILE H 0.000 . 2.300 1.934 1.645 2.336 0.036 14 0 "[ . 1 . 2]" 4
45 1 170 ASP O 1 174 LEU N 0.000 . 3.300 2.942 2.613 3.161 . 0 0 "[ . 1 . 2]" 4
46 1 170 ASP O 1 174 LEU H 0.000 . 2.300 2.169 1.874 2.334 0.034 12 0 "[ . 1 . 2]" 4
47 2 29 GLU O 2 33 ARG N 0.000 . 3.300 3.102 2.548 3.305 0.005 4 0 "[ . 1 . 2]" 4
48 2 29 GLU O 2 33 ARG H 0.000 . 2.300 2.191 1.641 2.346 0.046 4 0 "[ . 1 . 2]" 4
49 2 30 GLN O 2 34 LEU N 0.000 . 3.300 2.723 2.548 2.915 . 0 0 "[ . 1 . 2]" 4
50 2 30 GLN O 2 34 LEU H 0.000 . 2.300 1.827 1.644 2.021 . 0 0 "[ . 1 . 2]" 4
51 2 31 TRP O 2 35 LEU N 0.000 . 3.300 3.284 2.822 3.361 0.061 19 0 "[ . 1 . 2]" 4
52 2 31 TRP O 2 35 LEU H 0.000 . 2.300 2.340 1.869 2.418 0.118 14 0 "[ . 1 . 2]" 4
53 2 32 ALA O 2 36 GLN N 0.000 . 3.300 2.602 2.493 2.793 . 0 0 "[ . 1 . 2]" 4
54 2 32 ALA O 2 36 GLN H 0.000 . 2.300 2.236 2.109 2.368 0.068 18 0 "[ . 1 . 2]" 4
stop_
save_
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